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

Systemtic Name: 5-azanyl-1-[2,6-bis(bromanyl)-4-(trifluoromethyl)phenyl]pyrazole-3-carbonitrile Openeye Name: 5-amino-1-[2,6-dibromo-4-(trifluoromethyl)phenyl]pyrazole-3-carbonitrile CAS Name: 5-amino-1-[2,6-dibromo-4-(trifluoromethyl)phenyl]-3-pyrazolecarbonitrile IUPAC Name: 5-amino-1-[2,6-dibromo-4-(trifluoromethyl)phenyl]pyrazole-3-carbonitrile Traditional Name: 5-amino-1-[2,6-dibromo-4-(trifluoromethyl)phenyl]pyrazole-3-carbonitrile Formula: C11H5Br2F3N4 MolecularWeight: 409.98741

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1Br)N2C(=CC(=N2)C#N)N)Br)C(F)(F)F

Isomeric SMILES

C1=C(C=C(C(=C1Br)N2C(=CC(=N2)C#N)N)Br)C(F)(F)F

InChI

InChI=1S/C11H5Br2F3N4/c12-7-1-5(11(14,15)16)2-8(13)10(7)20-9(18)3-6(4-17)19-20/h1-3H,18H2