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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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