3-azanyl-5-[3-(trifluoromethyl)phenyl]-1H-pyrazole-4-carbonitrile

Systemtic Name: 3-azanyl-5-[3-(trifluoromethyl)phenyl]-1H-pyrazole-4-carbonitrile Openeye Name: 3-amino-5-[3-(trifluoromethyl)phenyl]-1H-pyrazole-4-carbonitrile CAS Name: 3-amino-5-[3-(trifluoromethyl)phenyl]-1H-pyrazole-4-carbonitrile IUPAC Name: 3-amino-5-[3-(trifluoromethyl)phenyl]-1H-pyrazole-4-carbonitrile Traditional Name: 3-amino-5-[3-(trifluoromethyl)phenyl]-1H-pyrazole-4-carbonitrile Formula: C11H7F3N4 MolecularWeight: 252.19529

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(F)(F)F)C2=C(C(=NN2)N)C#N

Isomeric SMILES

C1=CC(=CC(=C1)C(F)(F)F)C2=C(C(=NN2)N)C#N

InChI

InChI=1S/C11H7F3N4/c12-11(13,14)7-3-1-2-6(4-7)9-8(5-15)10(16)18-17-9/h1-4H,(H3,16,17,18)