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

Systemtic Name: 1-(2,4-dichlorophenyl)-4-methyl-5-(4-methylthiophen-2-yl)pyrazole-3-carboxylic acid Openeye Name: 1-(2,4-dichlorophenyl)-4-methyl-5-(4-methyl-2-thienyl)pyrazole-3-carboxylic acid CAS Name: 1-(2,4-dichlorophenyl)-4-methyl-5-(4-methyl-2-thiophenyl)-3-pyrazolecarboxylic acid IUPAC Name: 1-(2,4-dichlorophenyl)-4-methyl-5-(4-methylthiophen-2-yl)pyrazole-3-carboxylic acid Traditional Name: 1-(2,4-dichlorophenyl)-4-methyl-5-(4-methyl-2-thienyl)pyrazole-3-carboxylic acid Formula: C16H12Cl2N2O2S MolecularWeight: 367.24968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=C1)C2=C(C(=NN2C3=C(C=C(C=C3)Cl)Cl)C(=O)O)C

Isomeric SMILES

CC1=CSC(=C1)C2=C(C(=NN2C3=C(C=C(C=C3)Cl)Cl)C(=O)O)C

InChI

InChI=1S/C16H12Cl2N2O2S/c1-8-5-13(23-7-8)15-9(2)14(16(21)22)19-20(15)12-4-3-10(17)6-11(12)18/h3-7H,1-2H3,(H,21,22)