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

Systemtic Name: 4-chloranyl-6-methyl-1-[3-(trifluoromethyl)phenyl]pyrazolo[3,4-d]pyrimidine Openeye Name: 4-chloro-6-methyl-1-[3-(trifluoromethyl)phenyl]pyrazolo[3,4-d]pyrimidine CAS Name: 4-chloro-6-methyl-1-[3-(trifluoromethyl)phenyl]pyrazolo[3,4-d]pyrimidine IUPAC Name: 4-chloro-6-methyl-1-[3-(trifluoromethyl)phenyl]pyrazolo[3,4-d]pyrimidine Traditional Name: 4-chloro-6-methyl-1-[3-(trifluoromethyl)phenyl]pyrazolo[3,4-d]pyrimidine Formula: C13H8ClF3N4 MolecularWeight: 312.67763

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=NN2C3=CC=CC(=C3)C(F)(F)F)C(=N1)Cl

Isomeric SMILES

CC1=NC2=C(C=NN2C3=CC=CC(=C3)C(F)(F)F)C(=N1)Cl

InChI

InChI=1S/C13H8ClF3N4/c1-7-19-11(14)10-6-18-21(12(10)20-7)9-4-2-3-8(5-9)13(15,16)17/h2-6H,1H3