3-[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]sulfanyl-6-methyl-1,2,4-triazin-5-olate

Systemtic Name: 3-[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]sulfanyl-6-methyl-1,2,4-triazin-5-olate Openeye Name: 3-[2-(2-furylmethylamino)-2-oxo-ethyl]sulfanyl-6-methyl-1,2,4-triazin-5-olate CAS Name: 3-[[2-(2-furanylmethylamino)-2-oxoethyl]thio]-6-methyl-1,2,4-triazin-5-olate IUPAC Name: 3-[2-(furan-2-ylmethylamino)-2-oxoethyl]sulfanyl-6-methyl-1,2,4-triazin-5-olate Traditional Name: 3-[[2-(2-furfurylamino)-2-keto-ethyl]thio]-6-methyl-1,2,4-triazin-5-olate Formula: C11H11N4O3S- MolecularWeight: 279.29504

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N=N1)SCC(=O)NCC2=CC=CO2)[O-]

Isomeric SMILES

CC1=C(N=C(N=N1)SCC(=O)NCC2=CC=CO2)[O-]

InChI

InChI=1S/C11H12N4O3S/c1-7-10(17)13-11(15-14-7)19-6-9(16)12-5-8-3-2-4-18-8/h2-4H,5-6H2,1H3,(H,12,16)(H,13,15,17)/p-1