methyl 4-[2-(1-phenylbenzimidazol-2-yl)sulfanylethanoylamino]benzoate

Systemtic Name: methyl 4-[2-(1-phenylbenzimidazol-2-yl)sulfanylethanoylamino]benzoate Openeye Name: methyl 4-[[2-(1-phenylbenzimidazol-2-yl)sulfanylacetyl]amino]benzoate CAS Name: 4-[[1-oxo-2-[(1-phenyl-2-benzimidazolyl)thio]ethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-(1-phenylbenzimidazol-2-yl)sulfanylacetyl]amino]benzoate Traditional Name: 4-[[2-[(1-phenylbenzimidazol-2-yl)thio]acetyl]amino]benzoic acid methyl ester Formula: C23H19N3O3S MolecularWeight: 417.48026

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3N2C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3N2C4=CC=CC=C4

InChI

InChI=1S/C23H19N3O3S/c1-29-22(28)16-11-13-17(14-12-16)24-21(27)15-30-23-25-19-9-5-6-10-20(19)26(23)18-7-3-2-4-8-18/h2-14H,15H2,1H3,(H,24,27)