1-[(4-methylphenyl)methyl]-3-thiophen-2-yl-pyrazole-4-carboxylic acid

Systemtic Name: 1-[(4-methylphenyl)methyl]-3-thiophen-2-yl-pyrazole-4-carboxylic acid Openeye Name: 1-(p-tolylmethyl)-3-(2-thienyl)pyrazole-4-carboxylic acid CAS Name: 1-[(4-methylphenyl)methyl]-3-thiophen-2-yl-4-pyrazolecarboxylic acid IUPAC Name: 1-[(4-methylphenyl)methyl]-3-thiophen-2-ylpyrazole-4-carboxylic acid Traditional Name: 1-(4-methylbenzyl)-3-(2-thienyl)pyrazole-4-carboxylic acid Formula: C16H14N2O2S MolecularWeight: 298.35956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C=C(C(=N2)C3=CC=CS3)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)CN2C=C(C(=N2)C3=CC=CS3)C(=O)O

InChI

InChI=1S/C16H14N2O2S/c1-11-4-6-12(7-5-11)9-18-10-13(16(19)20)15(17-18)14-3-2-8-21-14/h2-8,10H,9H2,1H3,(H,19,20)