1-(2-methylpropyl)-3-(5-methylthiophen-2-yl)pyrazole-4-carboxylic acid

Systemtic Name: 1-(2-methylpropyl)-3-(5-methylthiophen-2-yl)pyrazole-4-carboxylic acid Openeye Name: 1-isobutyl-3-(5-methyl-2-thienyl)pyrazole-4-carboxylic acid CAS Name: 1-(2-methylpropyl)-3-(5-methyl-2-thiophenyl)-4-pyrazolecarboxylic acid IUPAC Name: 1-(2-methylpropyl)-3-(5-methylthiophen-2-yl)pyrazole-4-carboxylic acid Traditional Name: 1-isobutyl-3-(5-methyl-2-thienyl)pyrazole-4-carboxylic acid Formula: C13H16N2O2S MolecularWeight: 264.34334

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C2=NN(C=C2C(=O)O)CC(C)C

Isomeric SMILES

CC1=CC=C(S1)C2=NN(C=C2C(=O)O)CC(C)C

InChI

InChI=1S/C13H16N2O2S/c1-8(2)6-15-7-10(13(16)17)12(14-15)11-5-4-9(3)18-11/h4-5,7-8H,6H2,1-3H3,(H,16,17)