1-[4-(3-ethanoylphenyl)-1,3-thiazol-2-yl]-5-methyl-pyrazole-4-carboxylic acid

Systemtic Name: 1-[4-(3-ethanoylphenyl)-1,3-thiazol-2-yl]-5-methyl-pyrazole-4-carboxylic acid Openeye Name: 1-[4-(3-acetylphenyl)thiazol-2-yl]-5-methyl-pyrazole-4-carboxylic acid CAS Name: 1-[4-(3-acetylphenyl)-2-thiazolyl]-5-methyl-4-pyrazolecarboxylic acid IUPAC Name: 1-[4-(3-acetylphenyl)-1,3-thiazol-2-yl]-5-methylpyrazole-4-carboxylic acid Traditional Name: 1-[4-(3-acetylphenyl)thiazol-2-yl]-5-methyl-pyrazole-4-carboxylic acid Formula: C16H13N3O3S MolecularWeight: 327.35772

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=NC(=CS2)C3=CC(=CC=C3)C(=O)C)C(=O)O

Isomeric SMILES

CC1=C(C=NN1C2=NC(=CS2)C3=CC(=CC=C3)C(=O)C)C(=O)O

InChI

InChI=1S/C16H13N3O3S/c1-9-13(15(21)22)7-17-19(9)16-18-14(8-23-16)12-5-3-4-11(6-12)10(2)20/h3-8H,1-2H3,(H,21,22)