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

Systemtic Name: 3-[2-(cycloheptylamino)-2-oxidanylidene-ethyl]sulfanyl-6-methyl-1,2,4-triazin-5-olate Openeye Name: 3-[2-(cycloheptylamino)-2-oxo-ethyl]sulfanyl-6-methyl-1,2,4-triazin-5-olate CAS Name: 3-[[2-(cycloheptylamino)-2-oxoethyl]thio]-6-methyl-1,2,4-triazin-5-olate IUPAC Name: 3-[2-(cycloheptylamino)-2-oxoethyl]sulfanyl-6-methyl-1,2,4-triazin-5-olate Traditional Name: 3-[[2-(cycloheptylamino)-2-keto-ethyl]thio]-6-methyl-1,2,4-triazin-5-olate Formula: C13H19N4O2S- MolecularWeight: 295.38056

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N=N1)SCC(=O)NC2CCCCCC2)[O-]

Isomeric SMILES

CC1=C(N=C(N=N1)SCC(=O)NC2CCCCCC2)[O-]

InChI

InChI=1S/C13H20N4O2S/c1-9-12(19)15-13(17-16-9)20-8-11(18)14-10-6-4-2-3-5-7-10/h10H,2-8H2,1H3,(H,14,18)(H,15,17,19)/p-1