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

Systemtic Name: 3-sulfanylidene-6-[(3,4,5-trimethoxyphenyl)methyl]-2H-1,2,4-triazin-5-one Openeye Name: 3-thioxo-6-[(3,4,5-trimethoxyphenyl)methyl]-2H-1,2,4-triazin-5-one CAS Name: 3-sulfanylidene-6-[(3,4,5-trimethoxyphenyl)methyl]-2H-1,2,4-triazin-5-one IUPAC Name: 3-sulfanylidene-6-[(3,4,5-trimethoxyphenyl)methyl]-2H-1,2,4-triazin-5-one Traditional Name: 3-thioxo-6-(3,4,5-trimethoxybenzyl)-2H-1,2,4-triazin-5-one Formula: C13H15N3O4S MolecularWeight: 309.3409

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CC2=NNC(=S)NC2=O

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CC2=NNC(=S)NC2=O

InChI

InChI=1S/C13H15N3O4S/c1-18-9-5-7(6-10(19-2)11(9)20-3)4-8-12(17)14-13(21)16-15-8/h5-6H,4H2,1-3H3,(H2,14,16,17,21)