2-[2-(thiophen-2-ylmethylsulfanyl)ethanoylamino]terephthalic acid

Systemtic Name: 2-[2-(thiophen-2-ylmethylsulfanyl)ethanoylamino]terephthalic acid Openeye Name: 2-[[2-(2-thienylmethylsulfanyl)acetyl]amino]terephthalic acid CAS Name: 2-[[1-oxo-2-(thiophen-2-ylmethylthio)ethyl]amino]terephthalic acid IUPAC Name: 2-[[2-(thiophen-2-ylmethylsulfanyl)acetyl]amino]terephthalic acid Traditional Name: 2-[[2-(2-thenylthio)acetyl]amino]terephthalic acid Formula: C15H13NO5S2 MolecularWeight: 351.39742

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H13NO5S2/c17-13(8-22-7-10-2-1-5-23-10)16-12-6-9(14(18)19)3-4-11(12)15(20)21/h1-6H,7-8H2,(H,16,17)(H,18,19)(H,20,21)