2-(1,3-benzodioxol-5-ylamino)-6-methyl-1H-pyrimidin-4-one

Systemtic Name: 2-(1,3-benzodioxol-5-ylamino)-6-methyl-1H-pyrimidin-4-one Openeye Name: 2-(1,3-benzodioxol-5-ylamino)-6-methyl-1H-pyrimidin-4-one CAS Name: 2-(1,3-benzodioxol-5-ylamino)-6-methyl-1H-pyrimidin-4-one IUPAC Name: 2-(1,3-benzodioxol-5-ylamino)-6-methyl-1H-pyrimidin-4-one Traditional Name: 2-(1,3-benzodioxol-5-ylamino)-6-methyl-1H-pyrimidin-4-one Formula: C12H11N3O3 MolecularWeight: 245.23404

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N=C(N1)NC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC1=CC(=O)N=C(N1)NC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C12H11N3O3/c1-7-4-11(16)15-12(13-7)14-8-2-3-9-10(5-8)18-6-17-9/h2-5H,6H2,1H3,(H2,13,14,15,16)