5-[2-(4-methylphenyl)sulfanylethanoylamino]thiophene-2-carboxylic acid

Systemtic Name: 5-[2-(4-methylphenyl)sulfanylethanoylamino]thiophene-2-carboxylic acid Openeye Name: 5-[[2-(p-tolylsulfanyl)acetyl]amino]thiophene-2-carboxylic acid CAS Name: 5-[[2-[(4-methylphenyl)thio]-1-oxoethyl]amino]-2-thiophenecarboxylic acid IUPAC Name: 5-[[2-(4-methylphenyl)sulfanylacetyl]amino]thiophene-2-carboxylic acid Traditional Name: 5-[[2-(p-tolylthio)acetyl]amino]-2-thenoic acid Formula: C14H13NO3S2 MolecularWeight: 307.38792

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC(=O)NC2=CC=C(S2)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)SCC(=O)NC2=CC=C(S2)C(=O)O

InChI

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