methyl 4-fluoranyl-3-[(2-phenylsulfanylpyridin-3-yl)carbonylamino]benzoate

Systemtic Name: methyl 4-fluoranyl-3-[(2-phenylsulfanylpyridin-3-yl)carbonylamino]benzoate Openeye Name: methyl 4-fluoro-3-[(2-phenylsulfanylpyridine-3-carbonyl)amino]benzoate CAS Name: 4-fluoro-3-[[oxo-[2-(phenylthio)-3-pyridinyl]methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-fluoro-3-[(2-phenylsulfanylpyridine-3-carbonyl)amino]benzoate Traditional Name: 4-fluoro-3-[[2-(phenylthio)nicotinoyl]amino]benzoic acid methyl ester Formula: C20H15FN2O3S MolecularWeight: 382.408103

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)F)NC(=O)C2=C(N=CC=C2)SC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)F)NC(=O)C2=C(N=CC=C2)SC3=CC=CC=C3

InChI

InChI=1S/C20H15FN2O3S/c1-26-20(25)13-9-10-16(21)17(12-13)23-18(24)15-8-5-11-22-19(15)27-14-6-3-2-4-7-14/h2-12H,1H3,(H,23,24)