1-[4-(4-ethanoylphenyl)sulfonylpiperazin-1-yl]-3-phenyl-butan-1-one

Systemtic Name: 1-[4-(4-ethanoylphenyl)sulfonylpiperazin-1-yl]-3-phenyl-butan-1-one Openeye Name: 1-[4-(4-acetylphenyl)sulfonylpiperazin-1-yl]-3-phenyl-butan-1-one CAS Name: 1-[4-(4-acetylphenyl)sulfonyl-1-piperazinyl]-3-phenyl-1-butanone IUPAC Name: 1-[4-(4-acetylphenyl)sulfonylpiperazin-1-yl]-3-phenylbutan-1-one Traditional Name: 1-[4-(4-acetylphenyl)sulfonylpiperazino]-3-phenyl-butan-1-one Formula: C22H26N2O4S MolecularWeight: 414.51784

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)C)C3=CC=CC=C3

Isomeric SMILES

CC(CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)C)C3=CC=CC=C3

InChI

InChI=1S/C22H26N2O4S/c1-17(19-6-4-3-5-7-19)16-22(26)23-12-14-24(15-13-23)29(27,28)21-10-8-20(9-11-21)18(2)25/h3-11,17H,12-16H2,1-2H3