6-azanyl-5-[3,4-bis(oxidanyl)phenyl]-3-methyl-2-methylsulfanyl-pyrimidin-4-one

Systemtic Name: 6-azanyl-5-[3,4-bis(oxidanyl)phenyl]-3-methyl-2-methylsulfanyl-pyrimidin-4-one Openeye Name: 6-amino-5-(3,4-dihydroxyphenyl)-3-methyl-2-methylsulfanyl-pyrimidin-4-one CAS Name: 6-amino-5-(3,4-dihydroxyphenyl)-3-methyl-2-(methylthio)-4-pyrimidinone IUPAC Name: 6-amino-5-(3,4-dihydroxyphenyl)-3-methyl-2-methylsulfanylpyrimidin-4-one Traditional Name: 6-amino-5-(3,4-dihydroxyphenyl)-3-methyl-2-(methylthio)pyrimidin-4-one Formula: C12H13N3O3S MolecularWeight: 279.31492

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=C(N=C1SC)N)C2=CC(=C(C=C2)O)O

Isomeric SMILES

CN1C(=O)C(=C(N=C1SC)N)C2=CC(=C(C=C2)O)O

InChI

InChI=1S/C12H13N3O3S/c1-15-11(18)9(10(13)14-12(15)19-2)6-3-4-7(16)8(17)5-6/h3-5,16-17H,13H2,1-2H3