5-azanyl-1-[4-(trifluoromethyl)phenyl]carbonyl-pyrazole-4-carbonitrile

Systemtic Name: 5-azanyl-1-[4-(trifluoromethyl)phenyl]carbonyl-pyrazole-4-carbonitrile Openeye Name: 5-amino-1-[4-(trifluoromethyl)benzoyl]pyrazole-4-carbonitrile CAS Name: 5-amino-1-[oxo-[4-(trifluoromethyl)phenyl]methyl]-4-pyrazolecarbonitrile IUPAC Name: 5-amino-1-[4-(trifluoromethyl)benzoyl]pyrazole-4-carbonitrile Traditional Name: 5-amino-1-[4-(trifluoromethyl)benzoyl]pyrazole-4-carbonitrile Formula: C12H7F3N4O MolecularWeight: 280.20539

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)N2C(=C(C=N2)C#N)N)C(F)(F)F

Isomeric SMILES

C1=CC(=CC=C1C(=O)N2C(=C(C=N2)C#N)N)C(F)(F)F

InChI

InChI=1S/C12H7F3N4O/c13-12(14,15)9-3-1-7(2-4-9)11(20)19-10(17)8(5-16)6-18-19/h1-4,6H,17H2