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

Systemtic Name: 1-(2,4-dichlorophenyl)-4-ethyl-5-(4-methylthiophen-2-yl)pyrazole-3-carboxylic acid Openeye Name: 1-(2,4-dichlorophenyl)-4-ethyl-5-(4-methyl-2-thienyl)pyrazole-3-carboxylic acid CAS Name: 1-(2,4-dichlorophenyl)-4-ethyl-5-(4-methyl-2-thiophenyl)-3-pyrazolecarboxylic acid IUPAC Name: 1-(2,4-dichlorophenyl)-4-ethyl-5-(4-methylthiophen-2-yl)pyrazole-3-carboxylic acid Traditional Name: 1-(2,4-dichlorophenyl)-4-ethyl-5-(4-methyl-2-thienyl)pyrazole-3-carboxylic acid Formula: C17H14Cl2N2O2S MolecularWeight: 381.27626

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N(N=C1C(=O)O)C2=C(C=C(C=C2)Cl)Cl)C3=CC(=CS3)C

Isomeric SMILES

CCC1=C(N(N=C1C(=O)O)C2=C(C=C(C=C2)Cl)Cl)C3=CC(=CS3)C

InChI

InChI=1S/C17H14Cl2N2O2S/c1-3-11-15(17(22)23)20-21(13-5-4-10(18)7-12(13)19)16(11)14-6-9(2)8-24-14/h4-8H,3H2,1-2H3,(H,22,23)