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

Systemtic Name: methyl 4-[2-(pyridin-4-ylcarbonylamino)-1,3-thiazol-4-yl]benzoate Openeye Name: methyl 4-[2-(pyridine-4-carbonylamino)thiazol-4-yl]benzoate CAS Name: 4-[2-[[oxo(pyridin-4-yl)methyl]amino]-4-thiazolyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-(pyridine-4-carbonylamino)-1,3-thiazol-4-yl]benzoate Traditional Name: 4-(2-isonicotinamidothiazol-4-yl)benzoic acid methyl ester Formula: C17H13N3O3S MolecularWeight: 339.36842

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC=NC=C3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC=NC=C3

InChI

InChI=1S/C17H13N3O3S/c1-23-16(22)13-4-2-11(3-5-13)14-10-24-17(19-14)20-15(21)12-6-8-18-9-7-12/h2-10H,1H3,(H,19,20,21)