[6,7-dimethyl-1-(phenylsulfonyl)indol-2-yl]-(4-methylpiperazin-1-yl)methanone

Systemtic Name: [6,7-dimethyl-1-(phenylsulfonyl)indol-2-yl]-(4-methylpiperazin-1-yl)methanone Openeye Name: [1-(benzenesulfonyl)-6,7-dimethyl-indol-2-yl]-(4-methylpiperazin-1-yl)methanone CAS Name: [1-(benzenesulfonyl)-6,7-dimethyl-2-indolyl]-(4-methyl-1-piperazinyl)methanone IUPAC Name: [1-(benzenesulfonyl)-6,7-dimethylindol-2-yl]-(4-methylpiperazin-1-yl)methanone Traditional Name: (1-besyl-6,7-dimethyl-indol-2-yl)-(4-methylpiperazino)methanone Formula: C22H25N3O3S MolecularWeight: 411.5172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C=C(N2S(=O)(=O)C3=CC=CC=C3)C(=O)N4CCN(CC4)C)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C=C(N2S(=O)(=O)C3=CC=CC=C3)C(=O)N4CCN(CC4)C)C

InChI

InChI=1S/C22H25N3O3S/c1-16-9-10-18-15-20(22(26)24-13-11-23(3)12-14-24)25(21(18)17(16)2)29(27,28)19-7-5-4-6-8-19/h4-10,15H,11-14H2,1-3H3