1-phenyl-4,6-bis(trifluoromethyl)pyrazolo[3,4-d]pyrimidine

Systemtic Name: 1-phenyl-4,6-bis(trifluoromethyl)pyrazolo[3,4-d]pyrimidine Openeye Name: 1-phenyl-4,6-bis(trifluoromethyl)pyrazolo[3,4-d]pyrimidine CAS Name: 1-phenyl-4,6-bis(trifluoromethyl)pyrazolo[3,4-d]pyrimidine IUPAC Name: 1-phenyl-4,6-bis(trifluoromethyl)pyrazolo[3,4-d]pyrimidine Traditional Name: 1-phenyl-4,6-bis(trifluoromethyl)pyrazolo[3,4-d]pyrimidine Formula: C13H6F6N4 MolecularWeight: 332.203959

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C3=NC(=NC(=C3C=N2)C(F)(F)F)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)N2C3=NC(=NC(=C3C=N2)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C13H6F6N4/c14-12(15,16)9-8-6-20-23(7-4-2-1-3-5-7)10(8)22-11(21-9)13(17,18)19/h1-6H