3-[(4-methyl-2-pyridin-4-yl-1,3-thiazol-5-yl)carbonylamino]benzoic acid

Systemtic Name: 3-[(4-methyl-2-pyridin-4-yl-1,3-thiazol-5-yl)carbonylamino]benzoic acid Openeye Name: 3-[[4-methyl-2-(4-pyridyl)thiazole-5-carbonyl]amino]benzoic acid CAS Name: 3-[[(4-methyl-2-pyridin-4-yl-5-thiazolyl)-oxomethyl]amino]benzoic acid IUPAC Name: 3-[(4-methyl-2-pyridin-4-yl-1,3-thiazole-5-carbonyl)amino]benzoic acid Traditional Name: 3-[[4-methyl-2-(4-pyridyl)thiazole-5-carbonyl]amino]benzoic acid Formula: C17H13N3O3S MolecularWeight: 339.36842

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)C2=CC=NC=C2)C(=O)NC3=CC=CC(=C3)C(=O)O

Isomeric SMILES

CC1=C(SC(=N1)C2=CC=NC=C2)C(=O)NC3=CC=CC(=C3)C(=O)O

InChI

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