1-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-2-(1H-indol-3-yl)ethanone

Systemtic Name: 1-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-2-(1H-indol-3-yl)ethanone Openeye Name: 1-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-2-(1H-indol-3-yl)ethanone CAS Name: 1-[4-(3,4-dimethylphenyl)sulfonyl-1-piperazinyl]-2-(1H-indol-3-yl)ethanone IUPAC Name: 1-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-2-(1H-indol-3-yl)ethanone Traditional Name: 1-[4-(3,4-dimethylphenyl)sulfonylpiperazino]-2-(1H-indol-3-yl)ethanone Formula: C22H25N3O3S MolecularWeight: 411.5172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CC3=CNC4=CC=CC=C43)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CC3=CNC4=CC=CC=C43)C

InChI

InChI=1S/C22H25N3O3S/c1-16-7-8-19(13-17(16)2)29(27,28)25-11-9-24(10-12-25)22(26)14-18-15-23-21-6-4-3-5-20(18)21/h3-8,13,15,23H,9-12,14H2,1-2H3