methyl 3-[(4-pyridin-4-yl-1,3-thiazol-2-yl)amino]benzoate

Systemtic Name: methyl 3-[(4-pyridin-4-yl-1,3-thiazol-2-yl)amino]benzoate Openeye Name: methyl 3-[[4-(4-pyridyl)thiazol-2-yl]amino]benzoate CAS Name: 3-[(4-pyridin-4-yl-2-thiazolyl)amino]benzoic acid methyl ester IUPAC Name: methyl 3-[(4-pyridin-4-yl-1,3-thiazol-2-yl)amino]benzoate Traditional Name: 3-[[4-(4-pyridyl)thiazol-2-yl]amino]benzoic acid methyl ester Formula: C16H13N3O2S MolecularWeight: 311.35832

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)NC2=NC(=CS2)C3=CC=NC=C3

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)NC2=NC(=CS2)C3=CC=NC=C3

InChI

InChI=1S/C16H13N3O2S/c1-21-15(20)12-3-2-4-13(9-12)18-16-19-14(10-22-16)11-5-7-17-8-6-11/h2-10H,1H3,(H,18,19)