N-[4-cyano-2-[2,3,6-tris(chloranyl)-4-methyl-phenyl]pyrazol-3-yl]ethanamide

Systemtic Name: N-[4-cyano-2-[2,3,6-tris(chloranyl)-4-methyl-phenyl]pyrazol-3-yl]ethanamide Openeye Name: N-[4-cyano-2-(2,3,6-trichloro-4-methyl-phenyl)pyrazol-3-yl]acetamide CAS Name: N-[4-cyano-2-(2,3,6-trichloro-4-methylphenyl)-3-pyrazolyl]acetamide IUPAC Name: N-[4-cyano-2-(2,3,6-trichloro-4-methylphenyl)pyrazol-3-yl]acetamide Traditional Name: N-[4-cyano-2-(2,3,6-trichloro-4-methyl-phenyl)pyrazol-3-yl]acetamide Formula: C13H9Cl3N4O MolecularWeight: 343.59576

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1Cl)Cl)N2C(=C(C=N2)C#N)NC(=O)C)Cl

Isomeric SMILES

CC1=CC(=C(C(=C1Cl)Cl)N2C(=C(C=N2)C#N)NC(=O)C)Cl

InChI

InChI=1S/C13H9Cl3N4O/c1-6-3-9(14)12(11(16)10(6)15)20-13(19-7(2)21)8(4-17)5-18-20/h3,5H,1-2H3,(H,19,21)