6-[(4-methoxyphenyl)methyl]-3-methylsulfanyl-2H-1,2,4-triazin-5-one

Systemtic Name: 6-[(4-methoxyphenyl)methyl]-3-methylsulfanyl-2H-1,2,4-triazin-5-one Openeye Name: 6-[(4-methoxyphenyl)methyl]-3-methylsulfanyl-2H-1,2,4-triazin-5-one CAS Name: 6-[(4-methoxyphenyl)methyl]-3-(methylthio)-2H-1,2,4-triazin-5-one IUPAC Name: 6-[(4-methoxyphenyl)methyl]-3-methylsulfanyl-2H-1,2,4-triazin-5-one Traditional Name: 3-(methylthio)-6-p-anisyl-2H-1,2,4-triazin-5-one Formula: C12H13N3O2S MolecularWeight: 263.31552

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC2=NNC(=NC2=O)SC

Isomeric SMILES

COC1=CC=C(C=C1)CC2=NNC(=NC2=O)SC

InChI

InChI=1S/C12H13N3O2S/c1-17-9-5-3-8(4-6-9)7-10-11(16)13-12(18-2)15-14-10/h3-6H,7H2,1-2H3,(H,13,15,16)