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

Systemtic Name: 5-[(3,5-dimethyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 5-[(3,5-dimethyl-4-oxo-cyclohexa-2,5-dien-1-ylidene)methylamino]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 5-[(3,5-dimethyl-4-oxo-1-cyclohexa-2,5-dienylidene)methylamino]-1-phenyl-4-pyrazolo[3,4-d]pyrimidinone IUPAC Name: 5-[(3,5-dimethyl-4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]-1-phenylpyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 5-[(4-keto-3,5-dimethyl-cyclohexa-2,5-dien-1-ylidene)methylamino]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one Formula: C20H17N5O2 MolecularWeight: 359.38128

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CNN2C=NC3=C(C2=O)C=NN3C4=CC=CC=C4)C=C(C1=O)C

Isomeric SMILES

CC1=CC(=CNN2C=NC3=C(C2=O)C=NN3C4=CC=CC=C4)C=C(C1=O)C

InChI

InChI=1S/C20H17N5O2/c1-13-8-15(9-14(2)18(13)26)10-22-24-12-21-19-17(20(24)27)11-23-25(19)16-6-4-3-5-7-16/h3-12,22H,1-2H3