5-azanyl-1-[2,6-bis(chloranyl)-4-(trifluoromethyl)phenyl]-3-methyl-pyrazole-4-carbonitrile

Systemtic Name: 5-azanyl-1-[2,6-bis(chloranyl)-4-(trifluoromethyl)phenyl]-3-methyl-pyrazole-4-carbonitrile Openeye Name: 5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-3-methyl-pyrazole-4-carbonitrile CAS Name: 5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-3-methyl-4-pyrazolecarbonitrile IUPAC Name: 5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-3-methylpyrazole-4-carbonitrile Traditional Name: 5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-3-methyl-pyrazole-4-carbonitrile Formula: C12H7Cl2F3N4 MolecularWeight: 335.11199

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C#N)N)C2=C(C=C(C=C2Cl)C(F)(F)F)Cl

Isomeric SMILES

CC1=NN(C(=C1C#N)N)C2=C(C=C(C=C2Cl)C(F)(F)F)Cl

InChI

InChI=1S/C12H7Cl2F3N4/c1-5-7(4-18)11(19)21(20-5)10-8(13)2-6(3-9(10)14)12(15,16)17/h2-3H,19H2,1H3