ethyl 2-[2-(cyanomethylsulfanyl)ethanoylamino]-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-(cyanomethylsulfanyl)ethanoylamino]-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(cyanomethylsulfanyl)acetyl]amino]-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-[[2-(cyanomethylthio)-1-oxoethyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(cyanomethylsulfanyl)acetyl]amino]-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-[[2-(cyanomethylthio)acetyl]amino]-4,5-dimethyl-thiophene-3-carboxylic acid ethyl ester Formula: C13H16N2O3S2 MolecularWeight: 312.40774

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)CSCC#N

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)CSCC#N

InChI

InChI=1S/C13H16N2O3S2/c1-4-18-13(17)11-8(2)9(3)20-12(11)15-10(16)7-19-6-5-14/h4,6-7H2,1-3H3,(H,15,16)