5-[(6-oxidanylidene-4-propoxy-cyclohexa-2,4-dien-1-ylidene)methylamino]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 5-[(6-oxidanylidene-4-propoxy-cyclohexa-2,4-dien-1-ylidene)methylamino]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 5-[(6-oxo-4-propoxy-cyclohexa-2,4-dien-1-ylidene)methylamino]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 5-[(6-oxo-4-propoxy-1-cyclohexa-2,4-dienylidene)methylamino]-1-phenyl-4-pyrazolo[3,4-d]pyrimidinone IUPAC Name: 5-[(6-oxo-4-propoxycyclohexa-2,4-dien-1-ylidene)methylamino]-1-phenylpyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 5-[(6-keto-4-propoxy-cyclohexa-2,4-dien-1-ylidene)methylamino]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one Formula: C21H19N5O3 MolecularWeight: 389.40726

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC(=O)C(=CNN2C=NC3=C(C2=O)C=NN3C4=CC=CC=C4)C=C1

Isomeric SMILES

CCCOC1=CC(=O)C(=CNN2C=NC3=C(C2=O)C=NN3C4=CC=CC=C4)C=C1

InChI

InChI=1S/C21H19N5O3/c1-2-10-29-17-9-8-15(19(27)11-17)12-23-25-14-22-20-18(21(25)28)13-24-26(20)16-6-4-3-5-7-16/h3-9,11-14,23H,2,10H2,1H3