5-[(2-methyl-5-methylsulfanyl-phenyl)carbonylamino]thiophene-2-carboxylic acid

Systemtic Name: 5-[(2-methyl-5-methylsulfanyl-phenyl)carbonylamino]thiophene-2-carboxylic acid Openeye Name: 5-[(2-methyl-5-methylsulfanyl-benzoyl)amino]thiophene-2-carboxylic acid CAS Name: 5-[[[2-methyl-5-(methylthio)phenyl]-oxomethyl]amino]-2-thiophenecarboxylic acid IUPAC Name: 5-[(2-methyl-5-methylsulfanylbenzoyl)amino]thiophene-2-carboxylic acid Traditional Name: 5-[[2-methyl-5-(methylthio)benzoyl]amino]-2-thenoic acid Formula: C14H13NO3S2 MolecularWeight: 307.38792

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H13NO3S2/c1-8-3-4-9(19-2)7-10(8)13(16)15-12-6-5-11(20-12)14(17)18/h3-7H,1-2H3,(H,15,16)(H,17,18)