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

Systemtic Name: 1-(4-methoxyphenyl)-4-methyl-5-(5-methylthiophen-2-yl)pyrazole-3-carboxylic acid Openeye Name: 1-(4-methoxyphenyl)-4-methyl-5-(5-methyl-2-thienyl)pyrazole-3-carboxylic acid CAS Name: 1-(4-methoxyphenyl)-4-methyl-5-(5-methyl-2-thiophenyl)-3-pyrazolecarboxylic acid IUPAC Name: 1-(4-methoxyphenyl)-4-methyl-5-(5-methylthiophen-2-yl)pyrazole-3-carboxylic acid Traditional Name: 1-(4-methoxyphenyl)-4-methyl-5-(5-methyl-2-thienyl)pyrazole-3-carboxylic acid Formula: C17H16N2O3S MolecularWeight: 328.38554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C2=C(C(=NN2C3=CC=C(C=C3)OC)C(=O)O)C

Isomeric SMILES

CC1=CC=C(S1)C2=C(C(=NN2C3=CC=C(C=C3)OC)C(=O)O)C

InChI

InChI=1S/C17H16N2O3S/c1-10-4-9-14(23-10)16-11(2)15(17(20)21)18-19(16)12-5-7-13(22-3)8-6-12/h4-9H,1-3H3,(H,20,21)