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

Systemtic Name: 2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-N-(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)propanamide Openeye Name: 2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)propanamide CAS Name: 2-[4-(2,5-dimethylphenyl)sulfonyl-1-piperazinyl]-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)propanamide IUPAC Name: 2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)propanamide Traditional Name: 2-[4-(2,5-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=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)C(C)C(=O)NC3=CC4=C(C=C3)NC(=O)N4

Isomeric SMILES

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

InChI

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