5-[2-(thiophen-2-ylmethylsulfanyl)ethanoylamino]thiophene-2-carboxylic acid

Systemtic Name: 5-[2-(thiophen-2-ylmethylsulfanyl)ethanoylamino]thiophene-2-carboxylic acid Openeye Name: 5-[[2-(2-thienylmethylsulfanyl)acetyl]amino]thiophene-2-carboxylic acid CAS Name: 5-[[1-oxo-2-(thiophen-2-ylmethylthio)ethyl]amino]-2-thiophenecarboxylic acid IUPAC Name: 5-[[2-(thiophen-2-ylmethylsulfanyl)acetyl]amino]thiophene-2-carboxylic acid Traditional Name: 5-[[2-(2-thenylthio)acetyl]amino]-2-thenoic acid Formula: C12H11NO3S3 MolecularWeight: 313.41564

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)CSCC(=O)NC2=CC=C(S2)C(=O)O

Isomeric SMILES

C1=CSC(=C1)CSCC(=O)NC2=CC=C(S2)C(=O)O

InChI

InChI=1S/C12H11NO3S3/c14-10(7-17-6-8-2-1-5-18-8)13-11-4-3-9(19-11)12(15)16/h1-5H,6-7H2,(H,13,14)(H,15,16)