2-methoxy-5-[[2-(thiophen-2-ylmethylsulfanyl)ethanoylamino]methyl]benzoic acid

Systemtic Name: 2-methoxy-5-[[2-(thiophen-2-ylmethylsulfanyl)ethanoylamino]methyl]benzoic acid Openeye Name: 2-methoxy-5-[[[2-(2-thienylmethylsulfanyl)acetyl]amino]methyl]benzoic acid CAS Name: 2-methoxy-5-[[[1-oxo-2-(thiophen-2-ylmethylthio)ethyl]amino]methyl]benzoic acid IUPAC Name: 2-methoxy-5-[[[2-(thiophen-2-ylmethylsulfanyl)acetyl]amino]methyl]benzoic acid Traditional Name: 2-methoxy-5-[[[2-(2-thenylthio)acetyl]amino]methyl]benzoic acid Formula: C16H17NO4S2 MolecularWeight: 351.44048

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)CSCC2=CC=CS2)C(=O)O

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)CSCC2=CC=CS2)C(=O)O

InChI

InChI=1S/C16H17NO4S2/c1-21-14-5-4-11(7-13(14)16(19)20)8-17-15(18)10-22-9-12-3-2-6-23-12/h2-7H,8-10H2,1H3,(H,17,18)(H,19,20)