5-methyl-2-(2-thiophen-2-ylsulfanylethanoylamino)benzoic acid

Systemtic Name: 5-methyl-2-(2-thiophen-2-ylsulfanylethanoylamino)benzoic acid Openeye Name: 5-methyl-2-[[2-(2-thienylsulfanyl)acetyl]amino]benzoic acid CAS Name: 5-methyl-2-[[1-oxo-2-(thiophen-2-ylthio)ethyl]amino]benzoic acid IUPAC Name: 5-methyl-2-[(2-thiophen-2-ylsulfanylacetyl)amino]benzoic acid Traditional Name: 5-methyl-2-[[2-(2-thienylthio)acetyl]amino]benzoic acid Formula: C14H13NO3S2 MolecularWeight: 307.38792

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)CSC2=CC=CS2)C(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)CSC2=CC=CS2)C(=O)O

InChI

InChI=1S/C14H13NO3S2/c1-9-4-5-11(10(7-9)14(17)18)15-12(16)8-20-13-3-2-6-19-13/h2-7H,8H2,1H3,(H,15,16)(H,17,18)