2-[3-[(4,5-dimethyl-1,3-thiazol-2-yl)amino]-3-oxidanylidene-propyl]pyrazole-3-carboxylic acid

Systemtic Name: 2-[3-[(4,5-dimethyl-1,3-thiazol-2-yl)amino]-3-oxidanylidene-propyl]pyrazole-3-carboxylic acid Openeye Name: 2-[3-[(4,5-dimethylthiazol-2-yl)amino]-3-oxo-propyl]pyrazole-3-carboxylic acid CAS Name: 2-[3-[(4,5-dimethyl-2-thiazolyl)amino]-3-oxopropyl]-3-pyrazolecarboxylic acid IUPAC Name: 2-[3-[(4,5-dimethyl-1,3-thiazol-2-yl)amino]-3-oxopropyl]pyrazole-3-carboxylic acid Traditional Name: 2-[3-[(4,5-dimethylthiazol-2-yl)amino]-3-keto-propyl]pyrazole-3-carboxylic acid Formula: C12H14N4O3S MolecularWeight: 294.32956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)CCN2C(=CC=N2)C(=O)O)C

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)CCN2C(=CC=N2)C(=O)O)C

InChI

InChI=1S/C12H14N4O3S/c1-7-8(2)20-12(14-7)15-10(17)4-6-16-9(11(18)19)3-5-13-16/h3,5H,4,6H2,1-2H3,(H,18,19)(H,14,15,17)