2-[3-(4-chlorophenyl)sulfonylindol-1-yl]-1-[4-(phenylmethyl)piperazin-1-yl]ethanone

Systemtic Name: 2-[3-(4-chlorophenyl)sulfonylindol-1-yl]-1-[4-(phenylmethyl)piperazin-1-yl]ethanone Openeye Name: 1-(4-benzylpiperazin-1-yl)-2-[3-(4-chlorophenyl)sulfonylindol-1-yl]ethanone CAS Name: 2-[3-(4-chlorophenyl)sulfonyl-1-indolyl]-1-[4-(phenylmethyl)-1-piperazinyl]ethanone IUPAC Name: 1-(4-benzylpiperazin-1-yl)-2-[3-(4-chlorophenyl)sulfonylindol-1-yl]ethanone Traditional Name: 1-(4-benzylpiperazino)-2-[3-(4-chlorophenyl)sulfonylindol-1-yl]ethanone Formula: C27H26ClN3O3S MolecularWeight: 508.03164

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C(=O)CN3C=C(C4=CC=CC=C43)S(=O)(=O)C5=CC=C(C=C5)Cl

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C(=O)CN3C=C(C4=CC=CC=C43)S(=O)(=O)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C27H26ClN3O3S/c28-22-10-12-23(13-11-22)35(33,34)26-19-31(25-9-5-4-8-24(25)26)20-27(32)30-16-14-29(15-17-30)18-21-6-2-1-3-7-21/h1-13,19H,14-18,20H2