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

Systemtic Name: 6-[(3,4-dimethoxyphenyl)methyl]-3-methylsulfanyl-2H-1,2,4-triazin-5-one Openeye Name: 6-[(3,4-dimethoxyphenyl)methyl]-3-methylsulfanyl-2H-1,2,4-triazin-5-one CAS Name: 6-[(3,4-dimethoxyphenyl)methyl]-3-(methylthio)-2H-1,2,4-triazin-5-one IUPAC Name: 6-[(3,4-dimethoxyphenyl)methyl]-3-methylsulfanyl-2H-1,2,4-triazin-5-one Traditional Name: 3-(methylthio)-6-veratryl-2H-1,2,4-triazin-5-one Formula: C13H15N3O3S MolecularWeight: 293.3415

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15N3O3S/c1-18-10-5-4-8(7-11(10)19-2)6-9-12(17)14-13(20-3)16-15-9/h4-5,7H,6H2,1-3H3,(H,14,16,17)