6-(3-methylphenyl)-1-phenyl-5,6,7,7a-tetrahydro-2H-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 6-(3-methylphenyl)-1-phenyl-5,6,7,7a-tetrahydro-2H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 6-(m-tolyl)-1-phenyl-5,6,7,7a-tetrahydro-2H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 6-(3-methylphenyl)-1-phenyl-5,6,7,7a-tetrahydro-2H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 6-(3-methylphenyl)-1-phenyl-5,6,7,7a-tetrahydro-2H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 6-(m-tolyl)-1-phenyl-5,6,7,7a-tetrahydro-2H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C18H18N4O MolecularWeight: 306.36172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2NC3C(=CNN3C4=CC=CC=C4)C(=O)N2

Isomeric SMILES

CC1=CC=CC(=C1)C2NC3C(=CNN3C4=CC=CC=C4)C(=O)N2

InChI

InChI=1S/C18H18N4O/c1-12-6-5-7-13(10-12)16-20-17-15(18(23)21-16)11-19-22(17)14-8-3-2-4-9-14/h2-11,16-17,19-20H,1H3,(H,21,23)