4-methyl-2-(1-phenylpyrazol-4-yl)-1,3-thiazole-5-carboxylic acid

Systemtic Name: 4-methyl-2-(1-phenylpyrazol-4-yl)-1,3-thiazole-5-carboxylic acid Openeye Name: 4-methyl-2-(1-phenylpyrazol-4-yl)thiazole-5-carboxylic acid CAS Name: 4-methyl-2-(1-phenyl-4-pyrazolyl)-5-thiazolecarboxylic acid IUPAC Name: 4-methyl-2-(1-phenylpyrazol-4-yl)-1,3-thiazole-5-carboxylic acid Traditional Name: 4-methyl-2-(1-phenylpyrazol-4-yl)thiazole-5-carboxylic acid Formula: C14H11N3O2S MolecularWeight: 285.32104

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)C2=CN(N=C2)C3=CC=CC=C3)C(=O)O

Isomeric SMILES

CC1=C(SC(=N1)C2=CN(N=C2)C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C14H11N3O2S/c1-9-12(14(18)19)20-13(16-9)10-7-15-17(8-10)11-5-3-2-4-6-11/h2-8H,1H3,(H,18,19)