1-(3-chloranyl-4-methyl-phenyl)-5-thiophen-2-yl-pyrazole-3-carboxylic acid

Systemtic Name: 1-(3-chloranyl-4-methyl-phenyl)-5-thiophen-2-yl-pyrazole-3-carboxylic acid Openeye Name: 1-(3-chloro-4-methyl-phenyl)-5-(2-thienyl)pyrazole-3-carboxylic acid CAS Name: 1-(3-chloro-4-methylphenyl)-5-thiophen-2-yl-3-pyrazolecarboxylic acid IUPAC Name: 1-(3-chloro-4-methylphenyl)-5-thiophen-2-ylpyrazole-3-carboxylic acid Traditional Name: 1-(3-chloro-4-methyl-phenyl)-5-(2-thienyl)pyrazole-3-carboxylic acid Formula: C15H11ClN2O2S MolecularWeight: 318.77804

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=CC(=N2)C(=O)O)C3=CC=CS3)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=CC(=N2)C(=O)O)C3=CC=CS3)Cl

InChI

InChI=1S/C15H11ClN2O2S/c1-9-4-5-10(7-11(9)16)18-13(14-3-2-6-21-14)8-12(17-18)15(19)20/h2-8H,1H3,(H,19,20)