2-[(7-azanyl-2,3-dihydro-1,4-benzodioxin-6-yl)sulfanyl]-6-methyl-1H-pyrimidin-4-one

Systemtic Name: 2-[(7-azanyl-2,3-dihydro-1,4-benzodioxin-6-yl)sulfanyl]-6-methyl-1H-pyrimidin-4-one Openeye Name: 2-[(7-amino-2,3-dihydro-1,4-benzodioxin-6-yl)sulfanyl]-6-methyl-1H-pyrimidin-4-one CAS Name: 2-[(7-amino-2,3-dihydro-1,4-benzodioxin-6-yl)thio]-6-methyl-1H-pyrimidin-4-one IUPAC Name: 2-[(7-amino-2,3-dihydro-1,4-benzodioxin-6-yl)sulfanyl]-6-methyl-1H-pyrimidin-4-one Traditional Name: 2-[(7-amino-2,3-dihydro-1,4-benzodioxin-6-yl)thio]-6-methyl-1H-pyrimidin-4-one Formula: C13H13N3O3S MolecularWeight: 291.32562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N=C(N1)SC2=CC3=C(C=C2N)OCCO3

Isomeric SMILES

CC1=CC(=O)N=C(N1)SC2=CC3=C(C=C2N)OCCO3

InChI

InChI=1S/C13H13N3O3S/c1-7-4-12(17)16-13(15-7)20-11-6-10-9(5-8(11)14)18-2-3-19-10/h4-6H,2-3,14H2,1H3,(H,15,16,17)