(4,6-dimethyl-1H-indol-2-yl)-[4-(phenylsulfonyl)piperazin-1-yl]methanone

Systemtic Name: (4,6-dimethyl-1H-indol-2-yl)-[4-(phenylsulfonyl)piperazin-1-yl]methanone Openeye Name: [4-(benzenesulfonyl)piperazin-1-yl]-(4,6-dimethyl-1H-indol-2-yl)methanone CAS Name: [4-(benzenesulfonyl)-1-piperazinyl]-(4,6-dimethyl-1H-indol-2-yl)methanone IUPAC Name: [4-(benzenesulfonyl)piperazin-1-yl]-(4,6-dimethyl-1H-indol-2-yl)methanone Traditional Name: (4-besylpiperazino)-(4,6-dimethyl-1H-indol-2-yl)methanone Formula: C21H23N3O3S MolecularWeight: 397.49062

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C=C(NC2=C1)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=C2C=C(NC2=C1)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4)C

InChI

InChI=1S/C21H23N3O3S/c1-15-12-16(2)18-14-20(22-19(18)13-15)21(25)23-8-10-24(11-9-23)28(26,27)17-6-4-3-5-7-17/h3-7,12-14,22H,8-11H2,1-2H3