1-(5-chloranylpentyl)-5-(5-chloranylthiophen-2-yl)-4-methyl-pyrazole-3-carboxylic acid

Systemtic Name: 1-(5-chloranylpentyl)-5-(5-chloranylthiophen-2-yl)-4-methyl-pyrazole-3-carboxylic acid Openeye Name: 1-(5-chloropentyl)-5-(5-chloro-2-thienyl)-4-methyl-pyrazole-3-carboxylic acid CAS Name: 1-(5-chloropentyl)-5-(5-chloro-2-thiophenyl)-4-methyl-3-pyrazolecarboxylic acid IUPAC Name: 1-(5-chloropentyl)-5-(5-chlorothiophen-2-yl)-4-methylpyrazole-3-carboxylic acid Traditional Name: 1-(5-chloropentyl)-5-(5-chloro-2-thienyl)-4-methyl-pyrazole-3-carboxylic acid Formula: C14H16Cl2N2O2S MolecularWeight: 347.26004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(N=C1C(=O)O)CCCCCCl)C2=CC=C(S2)Cl

Isomeric SMILES

CC1=C(N(N=C1C(=O)O)CCCCCCl)C2=CC=C(S2)Cl

InChI

InChI=1S/C14H16Cl2N2O2S/c1-9-12(14(19)20)17-18(8-4-2-3-7-15)13(9)10-5-6-11(16)21-10/h5-6H,2-4,7-8H2,1H3,(H,19,20)