5-[(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)methylamino]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 5-[(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)methylamino]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 5-[(4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 5-[(4-oxo-1-cyclohexa-2,5-dienylidene)methylamino]-1-phenyl-4-pyrazolo[3,4-d]pyrimidinone IUPAC Name: 5-[(4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]-1-phenylpyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 5-[(4-ketocyclohexa-2,5-dien-1-ylidene)methylamino]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one Formula: C18H13N5O2 MolecularWeight: 331.32812

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C3=C(C=N2)C(=O)N(C=N3)NC=C4C=CC(=O)C=C4

Isomeric SMILES

C1=CC=C(C=C1)N2C3=C(C=N2)C(=O)N(C=N3)NC=C4C=CC(=O)C=C4

InChI

InChI=1S/C18H13N5O2/c24-15-8-6-13(7-9-15)10-20-22-12-19-17-16(18(22)25)11-21-23(17)14-4-2-1-3-5-14/h1-12,20H