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

Systemtic Name: 1-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-5-propan-2-yl-pyrazole-4-carboxylic acid Openeye Name: 5-isopropyl-1-[4-(p-tolyl)thiazol-2-yl]pyrazole-4-carboxylic acid CAS Name: 1-[4-(4-methylphenyl)-2-thiazolyl]-5-propan-2-yl-4-pyrazolecarboxylic acid IUPAC Name: 1-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-5-propan-2-ylpyrazole-4-carboxylic acid Traditional Name: 5-isopropyl-1-[4-(p-tolyl)thiazol-2-yl]pyrazole-4-carboxylic acid Formula: C17H17N3O2S MolecularWeight: 327.40078

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC(=N2)N3C(=C(C=N3)C(=O)O)C(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC(=N2)N3C(=C(C=N3)C(=O)O)C(C)C

InChI

InChI=1S/C17H17N3O2S/c1-10(2)15-13(16(21)22)8-18-20(15)17-19-14(9-23-17)12-6-4-11(3)5-7-12/h4-10H,1-3H3,(H,21,22)