propan-2-yl 3-[2-(1-methylbenzimidazol-2-yl)sulfanylethanoylamino]benzoate

Systemtic Name: propan-2-yl 3-[2-(1-methylbenzimidazol-2-yl)sulfanylethanoylamino]benzoate Openeye Name: isopropyl 3-[[2-(1-methylbenzimidazol-2-yl)sulfanylacetyl]amino]benzoate CAS Name: 3-[[2-[(1-methyl-2-benzimidazolyl)thio]-1-oxoethyl]amino]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-[[2-(1-methylbenzimidazol-2-yl)sulfanylacetyl]amino]benzoate Traditional Name: 3-[[2-[(1-methylbenzimidazol-2-yl)thio]acetyl]amino]benzoic acid isopropyl ester Formula: C20H21N3O3S MolecularWeight: 383.46404

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=CC(=CC=C1)NC(=O)CSC2=NC3=CC=CC=C3N2C

Isomeric SMILES

CC(C)OC(=O)C1=CC(=CC=C1)NC(=O)CSC2=NC3=CC=CC=C3N2C

InChI

InChI=1S/C20H21N3O3S/c1-13(2)26-19(25)14-7-6-8-15(11-14)21-18(24)12-27-20-22-16-9-4-5-10-17(16)23(20)3/h4-11,13H,12H2,1-3H3,(H,21,24)