5-[2-(cyanomethylsulfanyl)ethanoylamino]-3-methyl-thiophene-2-carboxylic acid

Systemtic Name: 5-[2-(cyanomethylsulfanyl)ethanoylamino]-3-methyl-thiophene-2-carboxylic acid Openeye Name: 5-[[2-(cyanomethylsulfanyl)acetyl]amino]-3-methyl-thiophene-2-carboxylic acid CAS Name: 5-[[2-(cyanomethylthio)-1-oxoethyl]amino]-3-methyl-2-thiophenecarboxylic acid IUPAC Name: 5-[[2-(cyanomethylsulfanyl)acetyl]amino]-3-methylthiophene-2-carboxylic acid Traditional Name: 5-[[2-(cyanomethylthio)acetyl]amino]-3-methyl-2-thenoic acid Formula: C10H10N2O3S2 MolecularWeight: 270.328

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1)NC(=O)CSCC#N)C(=O)O

Isomeric SMILES

CC1=C(SC(=C1)NC(=O)CSCC#N)C(=O)O

InChI

InChI=1S/C10H10N2O3S2/c1-6-4-8(17-9(6)10(14)15)12-7(13)5-16-3-2-11/h4H,3,5H2,1H3,(H,12,13)(H,14,15)