2-[(5-azanyl-2-oxidanyl-phenyl)methylsulfanyl]-6-methyl-1H-pyrimidin-4-one

Systemtic Name: 2-[(5-azanyl-2-oxidanyl-phenyl)methylsulfanyl]-6-methyl-1H-pyrimidin-4-one Openeye Name: 2-[(5-amino-2-hydroxy-phenyl)methylsulfanyl]-6-methyl-1H-pyrimidin-4-one CAS Name: 2-[(5-amino-2-hydroxyphenyl)methylthio]-6-methyl-1H-pyrimidin-4-one IUPAC Name: 2-[(5-amino-2-hydroxyphenyl)methylsulfanyl]-6-methyl-1H-pyrimidin-4-one Traditional Name: 2-[(5-amino-2-hydroxy-benzyl)thio]-6-methyl-1H-pyrimidin-4-one Formula: C12H13N3O2S MolecularWeight: 263.31552

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N=C(N1)SCC2=C(C=CC(=C2)N)O

Isomeric SMILES

CC1=CC(=O)N=C(N1)SCC2=C(C=CC(=C2)N)O

InChI

InChI=1S/C12H13N3O2S/c1-7-4-11(17)15-12(14-7)18-6-8-5-9(13)2-3-10(8)16/h2-5,16H,6,13H2,1H3,(H,14,15,17)