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

Systemtic Name: 5-[(3-chloranyl-5-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 5-[(3-chloro-5-methoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)methylamino]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 5-[(3-chloro-5-methoxy-4-oxo-1-cyclohexa-2,5-dienylidene)methylamino]-1-phenyl-4-pyrazolo[3,4-d]pyrimidinone IUPAC Name: 5-[(3-chloro-5-methoxy-4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]-1-phenylpyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 5-[(3-chloro-4-keto-5-methoxy-cyclohexa-2,5-dien-1-ylidene)methylamino]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one Formula: C19H14ClN5O3 MolecularWeight: 395.79916

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CNN2C=NC3=C(C2=O)C=NN3C4=CC=CC=C4)C=C(C1=O)Cl

Isomeric SMILES

COC1=CC(=CNN2C=NC3=C(C2=O)C=NN3C4=CC=CC=C4)C=C(C1=O)Cl

InChI

InChI=1S/C19H14ClN5O3/c1-28-16-8-12(7-15(20)17(16)26)9-22-24-11-21-18-14(19(24)27)10-23-25(18)13-5-3-2-4-6-13/h2-11,22H,1H3