2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-N-(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)propanamide

Systemtic Name: 2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-N-(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)propanamide Openeye Name: 2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)propanamide CAS Name: 2-[4-(3,4-dimethylphenyl)sulfonyl-1-piperazinyl]-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)propanamide IUPAC Name: 2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)propanamide Traditional Name: 2-[4-(3,4-dimethylphenyl)sulfonylpiperazino]-N-(2-keto-1,3-dihydrobenzimidazol-5-yl)propionamide Formula: C22H27N5O4S MolecularWeight: 457.54588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(C)C(=O)NC3=CC4=C(C=C3)NC(=O)N4)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(C)C(=O)NC3=CC4=C(C=C3)NC(=O)N4)C

InChI

InChI=1S/C22H27N5O4S/c1-14-4-6-18(12-15(14)2)32(30,31)27-10-8-26(9-11-27)16(3)21(28)23-17-5-7-19-20(13-17)25-22(29)24-19/h4-7,12-13,16H,8-11H2,1-3H3,(H,23,28)(H2,24,25,29)