5-(2-methylpropylamino)-1-[2,3,4-tris(chloranyl)phenyl]pyrazole-4-carbonitrile

Systemtic Name: 5-(2-methylpropylamino)-1-[2,3,4-tris(chloranyl)phenyl]pyrazole-4-carbonitrile Openeye Name: 5-(isobutylamino)-1-(2,3,4-trichlorophenyl)pyrazole-4-carbonitrile CAS Name: 5-(2-methylpropylamino)-1-(2,3,4-trichlorophenyl)-4-pyrazolecarbonitrile IUPAC Name: 5-(2-methylpropylamino)-1-(2,3,4-trichlorophenyl)pyrazole-4-carbonitrile Traditional Name: 5-(isobutylamino)-1-(2,3,4-trichlorophenyl)pyrazole-4-carbonitrile Formula: C14H13Cl3N4 MolecularWeight: 343.63882

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC1=C(C=NN1C2=C(C(=C(C=C2)Cl)Cl)Cl)C#N

Isomeric SMILES

CC(C)CNC1=C(C=NN1C2=C(C(=C(C=C2)Cl)Cl)Cl)C#N

InChI

InChI=1S/C14H13Cl3N4/c1-8(2)6-19-14-9(5-18)7-20-21(14)11-4-3-10(15)12(16)13(11)17/h3-4,7-8,19H,6H2,1-2H3