3-methyl-5-[2-(2-methylphenyl)sulfanylethanoylamino]thiophene-2-carboxylic acid

Systemtic Name: 3-methyl-5-[2-(2-methylphenyl)sulfanylethanoylamino]thiophene-2-carboxylic acid Openeye Name: 3-methyl-5-[[2-(o-tolylsulfanyl)acetyl]amino]thiophene-2-carboxylic acid CAS Name: 3-methyl-5-[[2-[(2-methylphenyl)thio]-1-oxoethyl]amino]-2-thiophenecarboxylic acid IUPAC Name: 3-methyl-5-[[2-(2-methylphenyl)sulfanylacetyl]amino]thiophene-2-carboxylic acid Traditional Name: 3-methyl-5-[[2-(o-tolylthio)acetyl]amino]-2-thenoic acid Formula: C15H15NO3S2 MolecularWeight: 321.4145

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1SCC(=O)NC2=CC(=C(S2)C(=O)O)C

Isomeric SMILES

CC1=CC=CC=C1SCC(=O)NC2=CC(=C(S2)C(=O)O)C

InChI

InChI=1S/C15H15NO3S2/c1-9-5-3-4-6-11(9)20-8-12(17)16-13-7-10(2)14(21-13)15(18)19/h3-7H,8H2,1-2H3,(H,16,17)(H,18,19)