1-(3,4-dimethylphenyl)-6-methyl-5-phenethyl-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 1-(3,4-dimethylphenyl)-6-methyl-5-phenethyl-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 1-(3,4-dimethylphenyl)-6-methyl-5-phenethyl-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 1-(3,4-dimethylphenyl)-6-methyl-5-phenethyl-4-pyrazolo[3,4-d]pyrimidinone IUPAC Name: 1-(3,4-dimethylphenyl)-6-methyl-5-phenethylpyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 1-(3,4-dimethylphenyl)-6-methyl-5-phenethyl-pyrazolo[3,4-d]pyrimidin-4-one Formula: C22H22N4O MolecularWeight: 358.43628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C3=C(C=N2)C(=O)N(C(=N3)C)CCC4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C3=C(C=N2)C(=O)N(C(=N3)C)CCC4=CC=CC=C4)C

InChI

InChI=1S/C22H22N4O/c1-15-9-10-19(13-16(15)2)26-21-20(14-23-26)22(27)25(17(3)24-21)12-11-18-7-5-4-6-8-18/h4-10,13-14H,11-12H2,1-3H3