5-(3-chloranyl-4-methoxy-phenyl)-6-methyl-1-(4-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 5-(3-chloranyl-4-methoxy-phenyl)-6-methyl-1-(4-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 5-(3-chloro-4-methoxy-phenyl)-6-methyl-1-(p-tolyl)pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 5-(3-chloro-4-methoxyphenyl)-6-methyl-1-(4-methylphenyl)-4-pyrazolo[3,4-d]pyrimidinone IUPAC Name: 5-(3-chloro-4-methoxyphenyl)-6-methyl-1-(4-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 5-(3-chloro-4-methoxy-phenyl)-6-methyl-1-(p-tolyl)pyrazolo[3,4-d]pyrimidin-4-one Formula: C20H17ClN4O2 MolecularWeight: 380.82758

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C3=C(C=N2)C(=O)N(C(=N3)C)C4=CC(=C(C=C4)OC)Cl

Isomeric SMILES

CC1=CC=C(C=C1)N2C3=C(C=N2)C(=O)N(C(=N3)C)C4=CC(=C(C=C4)OC)Cl

InChI

InChI=1S/C20H17ClN4O2/c1-12-4-6-14(7-5-12)25-19-16(11-22-25)20(26)24(13(2)23-19)15-8-9-18(27-3)17(21)10-15/h4-11H,1-3H3