5-[(E)-2,3-dihydro-1,4-benzodioxin-6-ylmethylideneamino]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 5-[(E)-2,3-dihydro-1,4-benzodioxin-6-ylmethylideneamino]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 5-[(E)-2,3-dihydro-1,4-benzodioxin-6-ylmethyleneamino]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 5-[(E)-2,3-dihydro-1,4-benzodioxin-6-ylmethylideneamino]-1-phenyl-4-pyrazolo[3,4-d]pyrimidinone IUPAC Name: 5-[(E)-2,3-dihydro-1,4-benzodioxin-6-ylmethylideneamino]-1-phenylpyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 5-[(E)-2,3-dihydro-1,4-benzodioxin-6-ylmethyleneamino]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one Formula: C20H15N5O3 MolecularWeight: 373.3648

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)C=NN3C=NC4=C(C3=O)C=NN4C5=CC=CC=C5

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)/C=N/N3C=NC4=C(C3=O)C=NN4C5=CC=CC=C5

InChI

InChI=1S/C20H15N5O3/c26-20-16-12-23-25(15-4-2-1-3-5-15)19(16)21-13-24(20)22-11-14-6-7-17-18(10-14)28-9-8-27-17/h1-7,10-13H,8-9H2/b22-11+