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

Systemtic Name: 6-[2-(cyclohexylmethylamino)-2-oxidanylidene-ethyl]sulfanyl-5-oxidanylidene-2H-1,2,4-triazin-3-olate Openeye Name: 6-[2-(cyclohexylmethylamino)-2-oxo-ethyl]sulfanyl-5-oxo-2H-1,2,4-triazin-3-olate CAS Name: 6-[[2-(cyclohexylmethylamino)-2-oxoethyl]thio]-5-oxo-2H-1,2,4-triazin-3-olate IUPAC Name: 6-[2-(cyclohexylmethylamino)-2-oxoethyl]sulfanyl-5-oxo-2H-1,2,4-triazin-3-olate Traditional Name: 6-[[2-(cyclohexylmethylamino)-2-keto-ethyl]thio]-5-keto-2H-1,2,4-triazin-3-olate Formula: C12H17N4O3S- MolecularWeight: 297.35338

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CNC(=O)CSC2=NNC(=NC2=O)[O-]

Isomeric SMILES

C1CCC(CC1)CNC(=O)CSC2=NNC(=NC2=O)[O-]

InChI

InChI=1S/C12H18N4O3S/c17-9(13-6-8-4-2-1-3-5-8)7-20-11-10(18)14-12(19)16-15-11/h8H,1-7H2,(H,13,17)(H2,14,16,18,19)/p-1