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

Systemtic Name: 1-(2-aminophenyl)-6-[(3-chlorophenyl)methyl]-2H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 1-(2-aminophenyl)-6-[(3-chlorophenyl)methyl]-2H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 1-(2-aminophenyl)-6-[(3-chlorophenyl)methyl]-2H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 1-(2-aminophenyl)-6-[(3-chlorophenyl)methyl]-2H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 1-(2-aminophenyl)-6-(3-chlorobenzyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C18H14ClN5O MolecularWeight: 351.78966

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)N)N2C3=NC(=NC(=O)C3=CN2)CC4=CC(=CC=C4)Cl

Isomeric SMILES

C1=CC=C(C(=C1)N)N2C3=NC(=NC(=O)C3=CN2)CC4=CC(=CC=C4)Cl

InChI

InChI=1S/C18H14ClN5O/c19-12-5-3-4-11(8-12)9-16-22-17-13(18(25)23-16)10-21-24(17)15-7-2-1-6-14(15)20/h1-8,10,21H,9,20H2