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

Systemtic Name: 1,3-dimethyl-5-[4-(2-phenylethanoyl)piperazin-1-yl]sulfonyl-benzimidazol-2-one Openeye Name: 1,3-dimethyl-5-[4-(2-phenylacetyl)piperazin-1-yl]sulfonyl-benzimidazol-2-one CAS Name: 1,3-dimethyl-5-[[4-(1-oxo-2-phenylethyl)-1-piperazinyl]sulfonyl]-2-benzimidazolone IUPAC Name: 1,3-dimethyl-5-[4-(2-phenylacetyl)piperazin-1-yl]sulfonylbenzimidazol-2-one Traditional Name: 1,3-dimethyl-5-[4-(2-phenylacetyl)piperazino]sulfonyl-benzimidazol-2-one Formula: C21H24N4O4S MolecularWeight: 428.50466

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)S(=O)(=O)N3CCN(CC3)C(=O)CC4=CC=CC=C4)N(C1=O)C

Isomeric SMILES

CN1C2=C(C=C(C=C2)S(=O)(=O)N3CCN(CC3)C(=O)CC4=CC=CC=C4)N(C1=O)C

InChI

InChI=1S/C21H24N4O4S/c1-22-18-9-8-17(15-19(18)23(2)21(22)27)30(28,29)25-12-10-24(11-13-25)20(26)14-16-6-4-3-5-7-16/h3-9,15H,10-14H2,1-2H3