6-[2-(4-ethoxycarbonylpiperidin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-5-oxidanylidene-2H-1,2,4-triazin-3-olate

Systemtic Name: 6-[2-(4-ethoxycarbonylpiperidin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-5-oxidanylidene-2H-1,2,4-triazin-3-olate Openeye Name: 6-[2-(4-ethoxycarbonyl-1-piperidyl)-2-oxo-ethyl]sulfanyl-5-oxo-2H-1,2,4-triazin-3-olate CAS Name: 6-[[2-(4-ethoxycarbonyl-1-piperidinyl)-2-oxoethyl]thio]-5-oxo-2H-1,2,4-triazin-3-olate IUPAC Name: 6-[2-(4-ethoxycarbonylpiperidin-1-yl)-2-oxoethyl]sulfanyl-5-oxo-2H-1,2,4-triazin-3-olate Traditional Name: 6-[[2-(4-carbethoxypiperidino)-2-keto-ethyl]thio]-5-keto-2H-1,2,4-triazin-3-olate Formula: C13H17N4O5S- MolecularWeight: 341.36288

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)CSC2=NNC(=NC2=O)[O-]

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)CSC2=NNC(=NC2=O)[O-]

InChI

InChI=1S/C13H18N4O5S/c1-2-22-12(20)8-3-5-17(6-4-8)9(18)7-23-11-10(19)14-13(21)16-15-11/h8H,2-7H2,1H3,(H2,14,16,19,21)/p-1