methyl 2-chloranyl-5-[2-[(4-phenyl-1,3-thiazol-2-yl)sulfanyl]ethanoylamino]benzoate

Systemtic Name: methyl 2-chloranyl-5-[2-[(4-phenyl-1,3-thiazol-2-yl)sulfanyl]ethanoylamino]benzoate Openeye Name: methyl 2-chloro-5-[[2-(4-phenylthiazol-2-yl)sulfanylacetyl]amino]benzoate CAS Name: 2-chloro-5-[[1-oxo-2-[(4-phenyl-2-thiazolyl)thio]ethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-chloro-5-[[2-[(4-phenyl-1,3-thiazol-2-yl)sulfanyl]acetyl]amino]benzoate Traditional Name: 2-chloro-5-[[2-[(4-phenylthiazol-2-yl)thio]acetyl]amino]benzoic acid methyl ester Formula: C19H15ClN2O3S2 MolecularWeight: 418.917

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC(=C1)NC(=O)CSC2=NC(=CS2)C3=CC=CC=C3)Cl

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1)NC(=O)CSC2=NC(=CS2)C3=CC=CC=C3)Cl

InChI

InChI=1S/C19H15ClN2O3S2/c1-25-18(24)14-9-13(7-8-15(14)20)21-17(23)11-27-19-22-16(10-26-19)12-5-3-2-4-6-12/h2-10H,11H2,1H3,(H,21,23)