24792905 -OEChem-04262419242D 75 79 0 1 0 0 0 0 0999 V2000 12.3923 0.2498 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 3.2498 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.8923 -0.6162 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.8923 1.1158 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.5794 -3.2498 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.2502 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 0.7498 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 1.7498 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.7498 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.9366 -1.5550 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 1.7498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 2.2498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 0.7498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 1.7498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 0.2498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 2.2498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 0.7498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 2.2498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2583 -0.2502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5202 -0.7502 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.1962 0.2498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.7498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9904 -0.2502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9366 0.0545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9904 -1.2502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1244 0.2498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2583 -1.2502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1244 -1.7502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5202 -0.7502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.2498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2473 -2.5055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.7498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.7502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2258 -2.7117 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.2498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.2502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.7502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.2502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.7502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 2.3698 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0588 2.7247 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2617 2.7247 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1836 0.8574 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5822 0.1672 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1369 1.6421 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7383 2.3324 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2617 -0.2252 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0588 -0.2252 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2742 0.1672 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6728 0.8574 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5947 2.7247 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7976 2.7247 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8019 -1.3025 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7976 -0.2252 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5947 -0.2252 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1181 2.3324 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7196 1.6421 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4740 0.3637 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6856 0.6214 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1244 0.8698 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7214 -1.5602 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1244 -2.3702 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.5202 -1.3702 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.1402 -0.7502 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.5202 -0.1302 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.3698 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -1.0602 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.0979 -3.3184 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.8324 -2.8396 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.3536 -2.1050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 0.5598 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.8702 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -0.2133 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -0.4402 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -1.2872 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 2 0 0 0 0 1 4 2 0 0 0 0 1 7 1 0 0 0 0 1 19 1 0 0 0 0 2 16 2 0 0 0 0 5 31 2 0 0 0 0 6 38 2 0 0 0 0 7 14 1 0 0 0 0 7 15 1 0 0 0 0 8 16 1 0 0 0 0 8 17 1 0 0 0 0 8 18 1 0 0 0 0 9 21 1 0 0 0 0 9 22 1 0 0 0 0 9 30 1 0 0 0 0 10 20 1 0 0 0 0 10 25 1 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 16 1 0 0 0 0 11 40 1 0 0 0 0 12 14 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 13 15 1 0 0 0 0 13 43 1 0 0 0 0 13 44 1 0 0 0 0 14 45 1 0 0 0 0 14 46 1 0 0 0 0 15 47 1 0 0 0 0 15 48 1 0 0 0 0 17 21 1 0 0 0 0 17 49 1 0 0 0 0 17 50 1 0 0 0 0 18 22 1 0 0 0 0 18 51 1 0 0 0 0 18 52 1 0 0 0 0 19 26 2 0 0 0 0 19 27 1 0 0 0 0 20 24 1 0 0 0 0 20 29 1 0 0 0 0 20 53 1 0 0 0 0 21 54 1 0 0 0 0 21 55 1 0 0 0 0 22 56 1 0 0 0 0 22 57 1 0 0 0 0 23 24 1 0 0 0 0 23 25 2 0 0 0 0 23 26 1 0 0 0 0 24 58 1 0 0 0 0 24 59 1 0 0 0 0 25 28 1 0 0 0 0 26 60 1 0 0 0 0 27 28 2 0 0 0 0 27 61 1 0 0 0 0 28 62 1 0 0 0 0 29 63 1 0 0 0 0 29 64 1 0 0 0 0 29 65 1 0 0 0 0 30 32 2 0 0 0 0 30 33 1 0 0 0 0 31 34 1 0 0 0 0 32 35 1 0 0 0 0 32 66 1 0 0 0 0 33 36 2 0 0 0 0 33 67 1 0 0 0 0 34 68 1 0 0 0 0 34 69 1 0 0 0 0 34 70 1 0 0 0 0 35 37 2 0 0 0 0 35 71 1 0 0 0 0 36 37 1 0 0 0 0 36 72 1 0 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 39 73 1 0 0 0 0 39 74 1 0 0 0 0 39 75 1 0 0 0 0 M END > 24792905 > 1 > 1020 > 7 > 0 > 5 > AAADcfB7uABAAAAAAAAAAAAAAAAAAWAAAAA8eIEAAAAAAFgBQAAAHgQAQAAADSzB2AQywYMAAAKIAqVSUHDCABAlAgAIiBkIZMgIYDLAlZGUIQhghgDIyYcciYCeCAQAgAACAAAQCAEAAAQAAAAAAAAAAA== > 1-[4-[4-[1-(1-acetyl-2-methyl-indolin-5-yl)sulfonylpiperidine-4-carbonyl]piperazin-1-yl]phenyl]ethanone > 1-[4-[4-[[1-[(1-acetyl-2-methyl-2,3-dihydroindol-5-yl)sulfonyl]-4-piperidinyl]-oxomethyl]-1-piperazinyl]phenyl]ethanone > 1-[4-[4-[1-[(1-acetyl-2-methyl-2,3-dihydroindol-5-yl)sulfonyl]piperidine-4-carbonyl]piperazin-1-yl]phenyl]ethanone > 1-[4-[4-[1-[(1-acetyl-2-methyl-2,3-dihydroindol-5-yl)sulfonyl]piperidine-4-carbonyl]piperazin-1-yl]phenyl]ethanone > 1-[4-[4-[1-[(1-ethanoyl-2-methyl-2,3-dihydroindol-5-yl)sulfonyl]piperidin-4-yl]carbonylpiperazin-1-yl]phenyl]ethanone > 1-[4-[4-[1-(1-acetyl-2-methyl-indolin-5-yl)sulfonylisonipecotoyl]piperazino]phenyl]ethanone > InChI=1S/C29H36N4O5S/c1-20-18-25-19-27(8-9-28(25)33(20)22(3)35)39(37,38)32-12-10-24(11-13-32)29(36)31-16-14-30(15-17-31)26-6-4-23(5-7-26)21(2)34/h4-9,19-20,24H,10-18H2,1-3H3 > FHKPRWLPNNWZSL-UHFFFAOYSA-N > 2.1 > 552.24064144 > C29H36N4O5S > 552.7 > CC1CC2=C(N1C(=O)C)C=CC(=C2)S(=O)(=O)N3CCC(CC3)C(=O)N4CCN(CC4)C5=CC=C(C=C5)C(=O)C > CC1CC2=C(N1C(=O)C)C=CC(=C2)S(=O)(=O)N3CCC(CC3)C(=O)N4CCN(CC4)C5=CC=C(C=C5)C(=O)C > 107 > 552.24064144 > 0 > 39 > 0 > 1 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 19 26 8 19 27 8 20 29 3 23 25 8 23 26 8 25 28 8 27 28 8 30 32 8 30 33 8 32 35 8 33 36 8 35 37 8 36 37 8 $$$$