3-[(4-methylphenyl)-(4-methylphenyl)sulfonyl-amino]-N-(1-propylbenzimidazol-2-yl)propanamide

Systemtic Name: 3-[(4-methylphenyl)-(4-methylphenyl)sulfonyl-amino]-N-(1-propylbenzimidazol-2-yl)propanamide Openeye Name: 3-[4-methyl-N-(p-tolylsulfonyl)anilino]-N-(1-propylbenzimidazol-2-yl)propanamide CAS Name: 3-(4-methyl-N-(4-methylphenyl)sulfonylanilino)-N-(1-propyl-2-benzimidazolyl)propanamide IUPAC Name: 3-(4-methyl-N-(4-methylphenyl)sulfonylanilino)-N-(1-propylbenzimidazol-2-yl)propanamide Traditional Name: 3-(4-methyl-N-tosyl-anilino)-N-(1-propylbenzimidazol-2-yl)propionamide Formula: C27H30N4O3S MolecularWeight: 490.6171

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=CC=CC=C2N=C1NC(=O)CCN(C3=CC=C(C=C3)C)S(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CCCN1C2=CC=CC=C2N=C1NC(=O)CCN(C3=CC=C(C=C3)C)S(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C27H30N4O3S/c1-4-18-30-25-8-6-5-7-24(25)28-27(30)29-26(32)17-19-31(22-13-9-20(2)10-14-22)35(33,34)23-15-11-21(3)12-16-23/h5-16H,4,17-19H2,1-3H3,(H,28,29,32)