methyl 4-[[3,5-bis(oxidanylidene)-2H-1,2,4-triazin-6-yl]sulfanyl]butanoate

Systemtic Name: methyl 4-[[3,5-bis(oxidanylidene)-2H-1,2,4-triazin-6-yl]sulfanyl]butanoate Openeye Name: methyl 4-[(3,5-dioxo-2H-1,2,4-triazin-6-yl)sulfanyl]butanoate CAS Name: 4-[(3,5-dioxo-2H-1,2,4-triazin-6-yl)thio]butanoic acid methyl ester IUPAC Name: methyl 4-[(3,5-dioxo-2H-1,2,4-triazin-6-yl)sulfanyl]butanoate Traditional Name: 4-[(3,5-diketo-2H-1,2,4-triazin-6-yl)thio]butyric acid methyl ester Formula: C8H11N3O4S MolecularWeight: 245.25564

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCSC1=NNC(=O)NC1=O

Isomeric SMILES

COC(=O)CCCSC1=NNC(=O)NC1=O

InChI

InChI=1S/C8H11N3O4S/c1-15-5(12)3-2-4-16-7-6(13)9-8(14)11-10-7/h2-4H2,1H3,(H2,9,11,13,14)