1,3-dimethyl-5-[4-(3-phenylpropanoyl)piperazin-1-yl]sulfonyl-benzimidazol-2-one

Systemtic Name: 1,3-dimethyl-5-[4-(3-phenylpropanoyl)piperazin-1-yl]sulfonyl-benzimidazol-2-one Openeye Name: 1,3-dimethyl-5-[4-(3-phenylpropanoyl)piperazin-1-yl]sulfonyl-benzimidazol-2-one CAS Name: 1,3-dimethyl-5-[[4-(1-oxo-3-phenylpropyl)-1-piperazinyl]sulfonyl]-2-benzimidazolone IUPAC Name: 1,3-dimethyl-5-[4-(3-phenylpropanoyl)piperazin-1-yl]sulfonylbenzimidazol-2-one Traditional Name: 5-(4-hydrocinnamoylpiperazino)sulfonyl-1,3-dimethyl-benzimidazol-2-one Formula: C22H26N4O4S MolecularWeight: 442.53124

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)S(=O)(=O)N3CCN(CC3)C(=O)CCC4=CC=CC=C4)N(C1=O)C

Isomeric SMILES

CN1C2=C(C=C(C=C2)S(=O)(=O)N3CCN(CC3)C(=O)CCC4=CC=CC=C4)N(C1=O)C

InChI

InChI=1S/C22H26N4O4S/c1-23-19-10-9-18(16-20(19)24(2)22(23)28)31(29,30)26-14-12-25(13-15-26)21(27)11-8-17-6-4-3-5-7-17/h3-7,9-10,16H,8,11-15H2,1-2H3