9918381 -OEChem-10101305032D 90 95 0 0 0 0 0 0 0999 V2000 6.3301 4.0000 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 5.5000 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -7.0000 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 5.3301 -6.0000 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 7.3301 -6.0000 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 4.5000 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 -0.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 3.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 7.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 0.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 1.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 4.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 4.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 4.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 5.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2583 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 5.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8222 3.9653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 6.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8222 6.0347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7282 4.4792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7282 5.5208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 4.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -4.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -4.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -5.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 4.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -6.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 1.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3267 1.9750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5297 1.9750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4516 0.1077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8501 -0.5826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5297 -0.9749 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3267 -0.9749 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4048 0.8923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0063 1.5826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2617 -0.9749 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0588 -0.9749 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1181 1.5826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7196 0.8923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9248 0.4749 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1278 0.4749 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2742 2.4174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6728 3.1077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9272 -0.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -0.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9272 -1.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -1.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5683 -0.5369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7953 0.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9483 0.5369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6592 5.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8150 3.3454 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8150 6.6546 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2639 4.1671 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2639 5.8329 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8626 4.9750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0656 4.9750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9272 -3.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -3.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9272 -4.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -4.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 2.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.8800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 2.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 27 1 0 0 0 0 1 40 1 0 0 0 0 2 47 1 0 0 0 0 3 49 1 0 0 0 0 4 49 1 0 0 0 0 5 49 1 0 0 0 0 6 50 1 0 0 0 0 7 21 1 0 0 0 0 7 32 1 0 0 0 0 8 20 2 0 0 0 0 9 35 2 0 0 0 0 10 16 1 0 0 0 0 10 17 1 0 0 0 0 10 18 1 0 0 0 0 11 13 1 0 0 0 0 11 19 1 0 0 0 0 11 20 1 0 0 0 0 12 22 1 0 0 0 0 12 26 1 0 0 0 0 12 27 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 53 1 0 0 0 0 14 17 1 0 0 0 0 14 56 1 0 0 0 0 14 57 1 0 0 0 0 15 16 1 0 0 0 0 15 54 1 0 0 0 0 15 55 1 0 0 0 0 16 60 1 0 0 0 0 16 61 1 0 0 0 0 17 58 1 0 0 0 0 17 59 1 0 0 0 0 18 21 1 0 0 0 0 18 62 1 0 0 0 0 18 63 1 0 0 0 0 19 23 1 0 0 0 0 19 64 1 0 0 0 0 19 65 1 0 0 0 0 20 22 1 0 0 0 0 21 66 1 0 0 0 0 21 67 1 0 0 0 0 22 68 1 0 0 0 0 22 69 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 24 28 1 0 0 0 0 24 70 1 0 0 0 0 25 29 2 0 0 0 0 25 71 1 0 0 0 0 26 31 1 0 0 0 0 26 34 2 0 0 0 0 27 33 2 0 0 0 0 28 30 2 0 0 0 0 28 72 1 0 0 0 0 29 30 1 0 0 0 0 29 73 1 0 0 0 0 30 36 1 0 0 0 0 31 35 1 0 0 0 0 31 37 2 0 0 0 0 32 74 1 0 0 0 0 32 75 1 0 0 0 0 32 76 1 0 0 0 0 33 35 1 0 0 0 0 33 77 1 0 0 0 0 34 38 1 0 0 0 0 34 78 1 0 0 0 0 36 41 2 0 0 0 0 36 42 1 0 0 0 0 37 39 1 0 0 0 0 37 79 1 0 0 0 0 38 39 2 0 0 0 0 38 80 1 0 0 0 0 39 81 1 0 0 0 0 40 43 1 0 0 0 0 40 82 1 0 0 0 0 40 83 1 0 0 0 0 41 44 1 0 0 0 0 41 84 1 0 0 0 0 42 45 2 0 0 0 0 42 85 1 0 0 0 0 43 47 2 0 0 0 0 43 48 1 0 0 0 0 44 46 2 0 0 0 0 44 86 1 0 0 0 0 45 46 1 0 0 0 0 45 87 1 0 0 0 0 46 49 1 0 0 0 0 47 50 1 0 0 0 0 48 51 2 0 0 0 0 48 88 1 0 0 0 0 50 52 2 0 0 0 0 51 52 1 0 0 0 0 51 89 1 0 0 0 0 52 90 1 0 0 0 0 M END > 9918381 > 1 > 1200 > 11 > 0 > 12 > AAADcfB/McBAAAAAAAAAAAAAAAAAAAAAAAA8YMGCAAAAAACBVAAAHwQAAAAADCzl2B6ywIMABAiIAqVSUACCAABlAhAIiAGIZMgKYDrg1bGVIYhghgDYyccYiMCOwAAAAAACAACAAAAAAAQAAAAAAAAAAA== > 2-[2-[(2,3-difluorophenyl)methylsulfanyl]-4-oxo-1-quinolyl]-N-[1-(2-methoxyethyl)-4-piperidyl]-N-[[4-[4-(trifluoromethyl)phenyl]phenyl]methyl]acetamide > 2-[2-[(2,3-difluorophenyl)methylthio]-4-oxo-1-quinolinyl]-N-[1-(2-methoxyethyl)-4-piperidinyl]-N-[[4-[4-(trifluoromethyl)phenyl]phenyl]methyl]acetamide > 2-[2-[(2,3-difluorophenyl)methylsulfanyl]-4-oxoquinolin-1-yl]-N-[1-(2-methoxyethyl)piperidin-4-yl]-N-[[4-[4-(trifluoromethyl)phenyl]phenyl]methyl]acetamide > 2-[2-[[2,3-bis(fluoranyl)phenyl]methylsulfanyl]-4-oxidanylidene-quinolin-1-yl]-N-[1-(2-methoxyethyl)piperidin-4-yl]-N-[[4-[4-(trifluoromethyl)phenyl]phenyl]methyl]ethanamide > 2-[2-[(2,3-difluorobenzyl)thio]-4-keto-1-quinolyl]-N-[1-(2-methoxyethyl)-4-piperidyl]-N-[4-[4-(trifluoromethyl)phenyl]benzyl]acetamide > InChI=1S/C40H38F5N3O3S/c1-51-22-21-46-19-17-32(18-20-46)47(24-27-9-11-28(12-10-27)29-13-15-31(16-14-29)40(43,44)45)37(50)25-48-35-8-3-2-6-33(35)36(49)23-38(48)52-26-30-5-4-7-34(41)39(30)42/h2-16,23,32H,17-22,24-26H2,1H3 > NNBGCSGCRSCFEA-UHFFFAOYSA-N > 8.1 > 735.255404 > C40H38F5N3O3S > 735.805036 > COCCN1CCC(CC1)N(CC2=CC=C(C=C2)C3=CC=C(C=C3)C(F)(F)F)C(=O)CN4C5=CC=CC=C5C(=O)C=C4SCC6=C(C(=CC=C6)F)F > COCCN1CCC(CC1)N(CC2=CC=C(C=C2)C3=CC=C(C=C3)C(F)(F)F)C(=O)CN4C5=CC=CC=C5C(=O)C=C4SCC6=C(C(=CC=C6)F)F > 78.4 > 735.255404 > 0 > 52 > 0 > 0 > 0 > 0 > 0 > 1 > 1 > 1 5 255 > 12 26 8 12 27 8 23 24 8 23 25 8 24 28 8 25 29 8 26 31 8 26 34 8 27 33 8 28 30 8 29 30 8 31 35 8 31 37 8 33 35 8 34 38 8 36 41 8 36 42 8 37 39 8 38 39 8 41 44 8 42 45 8 43 47 8 43 48 8 44 46 8 45 46 8 47 50 8 48 51 8 50 52 8 51 52 8 $$$$