5-[(E)-(4-chlorophenyl)methylideneamino]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 5-[(E)-(4-chlorophenyl)methylideneamino]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 5-[(E)-(4-chlorophenyl)methyleneamino]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 5-[(E)-(4-chlorophenyl)methylideneamino]-1-phenyl-4-pyrazolo[3,4-d]pyrimidinone IUPAC Name: 5-[(E)-(4-chlorophenyl)methylideneamino]-1-phenylpyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 5-[(E)-(4-chlorobenzylidene)amino]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one Formula: C18H12ClN5O MolecularWeight: 349.77378

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C3=C(C=N2)C(=O)N(C=N3)N=CC4=CC=C(C=C4)Cl

Isomeric SMILES

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

InChI

InChI=1S/C18H12ClN5O/c19-14-8-6-13(7-9-14)10-21-23-12-20-17-16(18(23)25)11-22-24(17)15-4-2-1-3-5-15/h1-12H/b21-10+