2-[2-(cyanomethylsulfanyl)ethanoylamino]-4,5-dimethyl-thiophene-3-carboxylic acid

Systemtic Name: 2-[2-(cyanomethylsulfanyl)ethanoylamino]-4,5-dimethyl-thiophene-3-carboxylic acid Openeye Name: 2-[[2-(cyanomethylsulfanyl)acetyl]amino]-4,5-dimethyl-thiophene-3-carboxylic acid CAS Name: 2-[[2-(cyanomethylthio)-1-oxoethyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid IUPAC Name: 2-[[2-(cyanomethylsulfanyl)acetyl]amino]-4,5-dimethylthiophene-3-carboxylic acid Traditional Name: 2-[[2-(cyanomethylthio)acetyl]amino]-4,5-dimethyl-3-thenoic acid Formula: C11H12N2O3S2 MolecularWeight: 284.35458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)O)NC(=O)CSCC#N)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)O)NC(=O)CSCC#N)C

InChI

InChI=1S/C11H12N2O3S2/c1-6-7(2)18-10(9(6)11(15)16)13-8(14)5-17-4-3-12/h4-5H2,1-2H3,(H,13,14)(H,15,16)