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

Systemtic Name: 3-[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-6-methyl-2H-1,2,4-triazin-5-one Openeye Name: 3-[2-(4-methoxyphenyl)-2-oxo-ethyl]sulfanyl-6-methyl-2H-1,2,4-triazin-5-one CAS Name: 3-[[2-(4-methoxyphenyl)-2-oxoethyl]thio]-6-methyl-2H-1,2,4-triazin-5-one IUPAC Name: 3-[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl-6-methyl-2H-1,2,4-triazin-5-one Traditional Name: 3-[[2-keto-2-(4-methoxyphenyl)ethyl]thio]-6-methyl-2H-1,2,4-triazin-5-one Formula: C13H13N3O3S MolecularWeight: 291.32562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NNC(=NC1=O)SCC(=O)C2=CC=C(C=C2)OC

Isomeric SMILES

CC1=NNC(=NC1=O)SCC(=O)C2=CC=C(C=C2)OC

InChI

InChI=1S/C13H13N3O3S/c1-8-12(18)14-13(16-15-8)20-7-11(17)9-3-5-10(19-2)6-4-9/h3-6H,7H2,1-2H3,(H,14,16,18)