2-(cyclohexylmethyl)-4-methyl-5-thiophen-3-yl-pyrazole-3-carboxylic acid

Systemtic Name: 2-(cyclohexylmethyl)-4-methyl-5-thiophen-3-yl-pyrazole-3-carboxylic acid Openeye Name: 2-(cyclohexylmethyl)-4-methyl-5-(3-thienyl)pyrazole-3-carboxylic acid CAS Name: 2-(cyclohexylmethyl)-4-methyl-5-(3-thiophenyl)-3-pyrazolecarboxylic acid IUPAC Name: 2-(cyclohexylmethyl)-4-methyl-5-thiophen-3-ylpyrazole-3-carboxylic acid Traditional Name: 2-(cyclohexylmethyl)-4-methyl-5-(3-thienyl)pyrazole-3-carboxylic acid Formula: C16H20N2O2S MolecularWeight: 304.4072

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(N=C1C2=CSC=C2)CC3CCCCC3)C(=O)O

Isomeric SMILES

CC1=C(N(N=C1C2=CSC=C2)CC3CCCCC3)C(=O)O

InChI

InChI=1S/C16H20N2O2S/c1-11-14(13-7-8-21-10-13)17-18(15(11)16(19)20)9-12-5-3-2-4-6-12/h7-8,10,12H,2-6,9H2,1H3,(H,19,20)