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

Systemtic Name: 1-[(5-ethylthiophen-2-yl)methyl]-3,5-dimethyl-pyrazole-4-carboxylic acid Openeye Name: 1-[(5-ethyl-2-thienyl)methyl]-3,5-dimethyl-pyrazole-4-carboxylic acid CAS Name: 1-[(5-ethyl-2-thiophenyl)methyl]-3,5-dimethyl-4-pyrazolecarboxylic acid IUPAC Name: 1-[(5-ethylthiophen-2-yl)methyl]-3,5-dimethylpyrazole-4-carboxylic acid Traditional Name: 1-[(5-ethyl-2-thienyl)methyl]-3,5-dimethyl-pyrazole-4-carboxylic acid Formula: C13H16N2O2S MolecularWeight: 264.34334

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(S1)CN2C(=C(C(=N2)C)C(=O)O)C

Isomeric SMILES

CCC1=CC=C(S1)CN2C(=C(C(=N2)C)C(=O)O)C

InChI

InChI=1S/C13H16N2O2S/c1-4-10-5-6-11(18-10)7-15-9(3)12(13(16)17)8(2)14-15/h5-6H,4,7H2,1-3H3,(H,16,17)