5,6-bis(azanyl)-2-(1,3-benzodioxol-4-yl)-1H-pyrimidin-4-one

Systemtic Name: 5,6-bis(azanyl)-2-(1,3-benzodioxol-4-yl)-1H-pyrimidin-4-one Openeye Name: 5,6-diamino-2-(1,3-benzodioxol-4-yl)-1H-pyrimidin-4-one CAS Name: 5,6-diamino-2-(1,3-benzodioxol-4-yl)-1H-pyrimidin-4-one IUPAC Name: 5,6-diamino-2-(1,3-benzodioxol-4-yl)-1H-pyrimidin-4-one Traditional Name: 5,6-diamino-2-(1,3-benzodioxol-4-yl)-1H-pyrimidin-4-one Formula: C11H10N4O3 MolecularWeight: 246.2221

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=CC=CC(=C2O1)C3=NC(=O)C(=C(N3)N)N

Isomeric SMILES

C1OC2=CC=CC(=C2O1)C3=NC(=O)C(=C(N3)N)N

InChI

InChI=1S/C11H10N4O3/c12-7-9(13)14-10(15-11(7)16)5-2-1-3-6-8(5)18-4-17-6/h1-3H,4,12H2,(H3,13,14,15,16)