(2-methyl-1-methylsulfonyl-2,3-dihydroindol-5-yl)-[4-(3-methylphenyl)piperazin-1-yl]methanone

Systemtic Name: (2-methyl-1-methylsulfonyl-2,3-dihydroindol-5-yl)-[4-(3-methylphenyl)piperazin-1-yl]methanone Openeye Name: (2-methyl-1-methylsulfonyl-indolin-5-yl)-[4-(m-tolyl)piperazin-1-yl]methanone CAS Name: (2-methyl-1-methylsulfonyl-2,3-dihydroindol-5-yl)-[4-(3-methylphenyl)-1-piperazinyl]methanone IUPAC Name: (2-methyl-1-methylsulfonyl-2,3-dihydroindol-5-yl)-[4-(3-methylphenyl)piperazin-1-yl]methanone Traditional Name: (1-mesyl-2-methyl-indolin-5-yl)-[4-(m-tolyl)piperazino]methanone Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=C(N1S(=O)(=O)C)C=CC(=C2)C(=O)N3CCN(CC3)C4=CC=CC(=C4)C

Isomeric SMILES

CC1CC2=C(N1S(=O)(=O)C)C=CC(=C2)C(=O)N3CCN(CC3)C4=CC=CC(=C4)C

InChI

InChI=1S/C22H27N3O3S/c1-16-5-4-6-20(13-16)23-9-11-24(12-10-23)22(26)18-7-8-21-19(15-18)14-17(2)25(21)29(3,27)28/h4-8,13,15,17H,9-12,14H2,1-3H3