5-[(2-chloranyl-5-methylsulfanyl-phenyl)carbonylamino]-3-methyl-thiophene-2-carboxylic acid

Systemtic Name: 5-[(2-chloranyl-5-methylsulfanyl-phenyl)carbonylamino]-3-methyl-thiophene-2-carboxylic acid Openeye Name: 5-[(2-chloro-5-methylsulfanyl-benzoyl)amino]-3-methyl-thiophene-2-carboxylic acid CAS Name: 5-[[[2-chloro-5-(methylthio)phenyl]-oxomethyl]amino]-3-methyl-2-thiophenecarboxylic acid IUPAC Name: 5-[(2-chloro-5-methylsulfanylbenzoyl)amino]-3-methylthiophene-2-carboxylic acid Traditional Name: 5-[[2-chloro-5-(methylthio)benzoyl]amino]-3-methyl-2-thenoic acid Formula: C14H12ClNO3S2 MolecularWeight: 341.83298

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1)NC(=O)C2=C(C=CC(=C2)SC)Cl)C(=O)O

Isomeric SMILES

CC1=C(SC(=C1)NC(=O)C2=C(C=CC(=C2)SC)Cl)C(=O)O

InChI

InChI=1S/C14H12ClNO3S2/c1-7-5-11(21-12(7)14(18)19)16-13(17)9-6-8(20-2)3-4-10(9)15/h3-6H,1-2H3,(H,16,17)(H,18,19)