3-(2-oxidanylidene-3H-benzimidazol-1-yl)propyl 2-[(3,4-dimethylphenyl)sulfonylamino]-3-oxidanyl-butanoate

Systemtic Name: 3-(2-oxidanylidene-3H-benzimidazol-1-yl)propyl 2-[(3,4-dimethylphenyl)sulfonylamino]-3-oxidanyl-butanoate Openeye Name: 3-(2-oxo-3H-benzimidazol-1-yl)propyl 2-[(3,4-dimethylphenyl)sulfonylamino]-3-hydroxy-butanoate CAS Name: 2-[(3,4-dimethylphenyl)sulfonylamino]-3-hydroxybutanoic acid 3-(2-oxo-3H-benzimidazol-1-yl)propyl ester IUPAC Name: 3-(2-oxo-3H-benzimidazol-1-yl)propyl 2-[(3,4-dimethylphenyl)sulfonylamino]-3-hydroxybutanoate Traditional Name: 2-[(3,4-dimethylphenyl)sulfonylamino]-3-hydroxy-butyric acid 3-(2-keto-3H-benzimidazol-1-yl)propyl ester Formula: C22H27N3O6S MolecularWeight: 461.53128

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NC(C(C)O)C(=O)OCCCN2C3=CC=CC=C3NC2=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NC(C(C)O)C(=O)OCCCN2C3=CC=CC=C3NC2=O)C

InChI

InChI=1S/C22H27N3O6S/c1-14-9-10-17(13-15(14)2)32(29,30)24-20(16(3)26)21(27)31-12-6-11-25-19-8-5-4-7-18(19)23-22(25)28/h4-5,7-10,13,16,20,24,26H,6,11-12H2,1-3H3,(H,23,28)