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

Systemtic Name: 3-[(4-methylphenyl)sulfonyl-phenyl-amino]-N-(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)propanamide Openeye Name: N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-3-[N-(p-tolylsulfonyl)anilino]propanamide CAS Name: 3-(N-(4-methylphenyl)sulfonylanilino)-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)propanamide IUPAC Name: 3-(N-(4-methylphenyl)sulfonylanilino)-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)propanamide Traditional Name: N-(2-keto-1,3-dihydrobenzimidazol-5-yl)-3-(N-tosylanilino)propionamide Formula: C23H22N4O4S MolecularWeight: 450.51018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CCC(=O)NC2=CC3=C(C=C2)NC(=O)N3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CCC(=O)NC2=CC3=C(C=C2)NC(=O)N3)C4=CC=CC=C4

InChI

InChI=1S/C23H22N4O4S/c1-16-7-10-19(11-8-16)32(30,31)27(18-5-3-2-4-6-18)14-13-22(28)24-17-9-12-20-21(15-17)26-23(29)25-20/h2-12,15H,13-14H2,1H3,(H,24,28)(H2,25,26,29)