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

Systemtic Name: 2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-N-(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)propanamide Openeye Name: N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-2-[4-(p-tolylsulfonyl)piperazin-1-yl]propanamide CAS Name: 2-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)propanamide IUPAC Name: 2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)propanamide Traditional Name: N-(2-keto-1,3-dihydrobenzimidazol-5-yl)-2-(4-tosylpiperazino)propionamide Formula: C21H25N5O4S MolecularWeight: 443.5193

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25N5O4S/c1-14-3-6-17(7-4-14)31(29,30)26-11-9-25(10-12-26)15(2)20(27)22-16-5-8-18-19(13-16)24-21(28)23-18/h3-8,13,15H,9-12H2,1-2H3,(H,22,27)(H2,23,24,28)