ethyl 5-azanyl-4-cyano-3-(diethylcarbamothioylsulfanylmethyl)thiophene-2-carboxylate

Systemtic Name: ethyl 5-azanyl-4-cyano-3-(diethylcarbamothioylsulfanylmethyl)thiophene-2-carboxylate Openeye Name: ethyl 5-amino-4-cyano-3-(diethylcarbamothioylsulfanylmethyl)thiophene-2-carboxylate CAS Name: 5-amino-4-cyano-3-[[[diethylamino(sulfanylidene)methyl]thio]methyl]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-4-cyano-3-(diethylcarbamothioylsulfanylmethyl)thiophene-2-carboxylate Traditional Name: 5-amino-4-cyano-3-[(diethylthiocarbamoylthio)methyl]thiophene-2-carboxylic acid ethyl ester Formula: C14H19N3O2S3 MolecularWeight: 357.51456

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=S)SCC1=C(SC(=C1C#N)N)C(=O)OCC

Isomeric SMILES

CCN(CC)C(=S)SCC1=C(SC(=C1C#N)N)C(=O)OCC

InChI

InChI=1S/C14H19N3O2S3/c1-4-17(5-2)14(20)21-8-10-9(7-15)12(16)22-11(10)13(18)19-6-3/h4-6,8,16H2,1-3H3