4,5-dimethyl-2-[(4-methylsulfanylphenyl)carbonylamino]thiophene-3-carboxylic acid

Systemtic Name: 4,5-dimethyl-2-[(4-methylsulfanylphenyl)carbonylamino]thiophene-3-carboxylic acid Openeye Name: 4,5-dimethyl-2-[(4-methylsulfanylbenzoyl)amino]thiophene-3-carboxylic acid CAS Name: 4,5-dimethyl-2-[[[4-(methylthio)phenyl]-oxomethyl]amino]-3-thiophenecarboxylic acid IUPAC Name: 4,5-dimethyl-2-[(4-methylsulfanylbenzoyl)amino]thiophene-3-carboxylic acid Traditional Name: 4,5-dimethyl-2-[[4-(methylthio)benzoyl]amino]-3-thenoic acid Formula: C15H15NO3S2 MolecularWeight: 321.4145

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)O)NC(=O)C2=CC=C(C=C2)SC)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)O)NC(=O)C2=CC=C(C=C2)SC)C

InChI

InChI=1S/C15H15NO3S2/c1-8-9(2)21-14(12(8)15(18)19)16-13(17)10-4-6-11(20-3)7-5-10/h4-7H,1-3H3,(H,16,17)(H,18,19)