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

Systemtic Name: 5-(3-chloranyl-4-methoxy-phenyl)-6-ethyl-1-(4-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 5-(3-chloro-4-methoxy-phenyl)-6-ethyl-1-(p-tolyl)pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 5-(3-chloro-4-methoxyphenyl)-6-ethyl-1-(4-methylphenyl)-4-pyrazolo[3,4-d]pyrimidinone IUPAC Name: 5-(3-chloro-4-methoxyphenyl)-6-ethyl-1-(4-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 5-(3-chloro-4-methoxy-phenyl)-6-ethyl-1-(p-tolyl)pyrazolo[3,4-d]pyrimidin-4-one Formula: C21H19ClN4O2 MolecularWeight: 394.85416

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(C=NN2C3=CC=C(C=C3)C)C(=O)N1C4=CC(=C(C=C4)OC)Cl

Isomeric SMILES

CCC1=NC2=C(C=NN2C3=CC=C(C=C3)C)C(=O)N1C4=CC(=C(C=C4)OC)Cl

InChI

InChI=1S/C21H19ClN4O2/c1-4-19-24-20-16(12-23-26(20)14-7-5-13(2)6-8-14)21(27)25(19)15-9-10-18(28-3)17(22)11-15/h5-12H,4H2,1-3H3