ethyl 2-(1,2,4-triazol-4-ylcarbamothioylsulfanyl)ethanoate

Systemtic Name: ethyl 2-(1,2,4-triazol-4-ylcarbamothioylsulfanyl)ethanoate Openeye Name: ethyl 2-(1,2,4-triazol-4-ylcarbamothioylsulfanyl)acetate CAS Name: 2-[[sulfanylidene-(1,2,4-triazol-4-ylamino)methyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-(1,2,4-triazol-4-ylcarbamothioylsulfanyl)acetate Traditional Name: 2-(1,2,4-triazol-4-ylthiocarbamoylthio)acetic acid ethyl ester Formula: C7H10N4O2S2 MolecularWeight: 246.3099

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC(=S)NN1C=NN=C1

Isomeric SMILES

CCOC(=O)CSC(=S)NN1C=NN=C1

InChI

InChI=1S/C7H10N4O2S2/c1-2-13-6(12)3-15-7(14)10-11-4-8-9-5-11/h4-5H,2-3H2,1H3,(H,10,14)