4-[3,5-bis(trifluoromethyl)phenoxy]-1-methyl-pyrazolo[3,4-d]pyrimidine

Systemtic Name: 4-[3,5-bis(trifluoromethyl)phenoxy]-1-methyl-pyrazolo[3,4-d]pyrimidine Openeye Name: 4-[3,5-bis(trifluoromethyl)phenoxy]-1-methyl-pyrazolo[3,4-d]pyrimidine CAS Name: 4-[3,5-bis(trifluoromethyl)phenoxy]-1-methylpyrazolo[3,4-d]pyrimidine IUPAC Name: 4-[3,5-bis(trifluoromethyl)phenoxy]-1-methylpyrazolo[3,4-d]pyrimidine Traditional Name: 4-[3,5-bis(trifluoromethyl)phenoxy]-1-methyl-pyrazolo[3,4-d]pyrimidine Formula: C14H8F6N4O MolecularWeight: 362.229939

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=NC=N2)OC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F

Isomeric SMILES

CN1C2=C(C=N1)C(=NC=N2)OC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C14H8F6N4O/c1-24-11-10(5-23-24)12(22-6-21-11)25-9-3-7(13(15,16)17)2-8(4-9)14(18,19)20/h2-6H,1H3