4-[(5-azanyl-3-methylsulfanyl-1,2,4-triazol-1-yl)carbothioylsulfanyl]butyl 5-azanyl-3-methylsulfanyl-1,2,4-triazole-1-carbodithioate

Systemtic Name: 4-[(5-azanyl-3-methylsulfanyl-1,2,4-triazol-1-yl)carbothioylsulfanyl]butyl 5-azanyl-3-methylsulfanyl-1,2,4-triazole-1-carbodithioate Openeye Name: 4-(5-amino-3-methylsulfanyl-1,2,4-triazole-1-carbothioyl)sulfanylbutyl 5-amino-3-methylsulfanyl-1,2,4-triazole-1-carbodithioate CAS Name: 5-amino-3-(methylthio)-1,2,4-triazole-1-carbodithioic acid 4-[[[5-amino-3-(methylthio)-1,2,4-triazol-1-yl]-sulfanylidenemethyl]thio]butyl ester IUPAC Name: 4-(5-amino-3-methylsulfanyl-1,2,4-triazole-1-carbothioyl)sulfanylbutyl 5-amino-3-methylsulfanyl-1,2,4-triazole-1-carbodithioate Traditional Name: 5-amino-3-(methylthio)-1,2,4-triazole-1-carbodithioic acid 4-[[5-amino-3-(methylthio)-1,2,4-triazole-1-carbothioyl]thio]butyl ester Formula: C12H18N8S6 MolecularWeight: 466.71492

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NN(C(=N1)N)C(=S)SCCCCSC(=S)N2C(=NC(=N2)SC)N

Isomeric SMILES

CSC1=NN(C(=N1)N)C(=S)SCCCCSC(=S)N2C(=NC(=N2)SC)N

InChI

InChI=1S/C12H18N8S6/c1-23-9-15-7(13)19(17-9)11(21)25-5-3-4-6-26-12(22)20-8(14)16-10(18-20)24-2/h3-6H2,1-2H3,(H2,13,15,17)(H2,14,16,18)