1-[4-(2,5-dimethylphenyl)piperazin-1-yl]-3-[(2-methyl-1-propanoyl-2,3-dihydroindol-5-yl)sulfonyl]propan-1-one

Systemtic Name: 1-[4-(2,5-dimethylphenyl)piperazin-1-yl]-3-[(2-methyl-1-propanoyl-2,3-dihydroindol-5-yl)sulfonyl]propan-1-one Openeye Name: 1-[4-(2,5-dimethylphenyl)piperazin-1-yl]-3-(2-methyl-1-propanoyl-indolin-5-yl)sulfonyl-propan-1-one CAS Name: 1-[4-(2,5-dimethylphenyl)-1-piperazinyl]-3-[[2-methyl-1-(1-oxopropyl)-2,3-dihydroindol-5-yl]sulfonyl]-1-propanone IUPAC Name: 1-[4-(2,5-dimethylphenyl)piperazin-1-yl]-3-[(2-methyl-1-propanoyl-2,3-dihydroindol-5-yl)sulfonyl]propan-1-one Traditional Name: 1-[4-(2,5-dimethylphenyl)piperazino]-3-(2-methyl-1-propionyl-indolin-5-yl)sulfonyl-propan-1-one Formula: C27H35N3O4S MolecularWeight: 497.6495

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1C(CC2=C1C=CC(=C2)S(=O)(=O)CCC(=O)N3CCN(CC3)C4=C(C=CC(=C4)C)C)C

Isomeric SMILES

CCC(=O)N1C(CC2=C1C=CC(=C2)S(=O)(=O)CCC(=O)N3CCN(CC3)C4=C(C=CC(=C4)C)C)C

InChI

InChI=1S/C27H35N3O4S/c1-5-26(31)30-21(4)17-22-18-23(8-9-24(22)30)35(33,34)15-10-27(32)29-13-11-28(12-14-29)25-16-19(2)6-7-20(25)3/h6-9,16,18,21H,5,10-15,17H2,1-4H3