1-(3-chlorophenyl)-3-methyl-6-(trifluoromethyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 1-(3-chlorophenyl)-3-methyl-6-(trifluoromethyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 1-(3-chlorophenyl)-3-methyl-6-(trifluoromethyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 1-(3-chlorophenyl)-3-methyl-6-(trifluoromethyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 1-(3-chlorophenyl)-3-methyl-6-(trifluoromethyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 1-(3-chlorophenyl)-3-methyl-6-(trifluoromethyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C13H8ClF3N4O MolecularWeight: 328.67703

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=NC(=NC2=O)C(F)(F)F)N(N1)C3=CC(=CC=C3)Cl

Isomeric SMILES

CC1=C2C(=NC(=NC2=O)C(F)(F)F)N(N1)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C13H8ClF3N4O/c1-6-9-10(18-12(13(15,16)17)19-11(9)22)21(20-6)8-4-2-3-7(14)5-8/h2-5,20H,1H3