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

Systemtic Name: 2-[2-(cyanomethylsulfanyl)ethanoylamino]thiophene-3-carboxylic acid Openeye Name: 2-[[2-(cyanomethylsulfanyl)acetyl]amino]thiophene-3-carboxylic acid CAS Name: 2-[[2-(cyanomethylthio)-1-oxoethyl]amino]-3-thiophenecarboxylic acid IUPAC Name: 2-[[2-(cyanomethylsulfanyl)acetyl]amino]thiophene-3-carboxylic acid Traditional Name: 2-[[2-(cyanomethylthio)acetyl]amino]-3-thenoic acid Formula: C9H8N2O3S2 MolecularWeight: 256.30142

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1C(=O)O)NC(=O)CSCC#N

Isomeric SMILES

C1=CSC(=C1C(=O)O)NC(=O)CSCC#N

InChI

InChI=1S/C9H8N2O3S2/c10-2-4-15-5-7(12)11-8-6(9(13)14)1-3-16-8/h1,3H,4-5H2,(H,11,12)(H,13,14)