4-[2-(thiophen-2-ylmethylsulfanyl)ethanoylamino]benzoic acid

Systemtic Name: 4-[2-(thiophen-2-ylmethylsulfanyl)ethanoylamino]benzoic acid Openeye Name: 4-[[2-(2-thienylmethylsulfanyl)acetyl]amino]benzoic acid CAS Name: 4-[[1-oxo-2-(thiophen-2-ylmethylthio)ethyl]amino]benzoic acid IUPAC Name: 4-[[2-(thiophen-2-ylmethylsulfanyl)acetyl]amino]benzoic acid Traditional Name: 4-[[2-(2-thenylthio)acetyl]amino]benzoic acid Formula: C14H13NO3S2 MolecularWeight: 307.38792

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)CSCC(=O)NC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

C1=CSC(=C1)CSCC(=O)NC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C14H13NO3S2/c16-13(9-19-8-12-2-1-7-20-12)15-11-5-3-10(4-6-11)14(17)18/h1-7H,8-9H2,(H,15,16)(H,17,18)