2-[3-(2-chlorophenyl)sulfanylpropanoylamino]thiophene-3-carboxylic acid

Systemtic Name: 2-[3-(2-chlorophenyl)sulfanylpropanoylamino]thiophene-3-carboxylic acid Openeye Name: 2-[3-(2-chlorophenyl)sulfanylpropanoylamino]thiophene-3-carboxylic acid CAS Name: 2-[[3-[(2-chlorophenyl)thio]-1-oxopropyl]amino]-3-thiophenecarboxylic acid IUPAC Name: 2-[3-(2-chlorophenyl)sulfanylpropanoylamino]thiophene-3-carboxylic acid Traditional Name: 2-[3-[(2-chlorophenyl)thio]propanoylamino]-3-thenoic acid Formula: C14H12ClNO3S2 MolecularWeight: 341.83298

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)SCCC(=O)NC2=C(C=CS2)C(=O)O)Cl

Isomeric SMILES

C1=CC=C(C(=C1)SCCC(=O)NC2=C(C=CS2)C(=O)O)Cl

InChI

InChI=1S/C14H12ClNO3S2/c15-10-3-1-2-4-11(10)20-8-6-12(17)16-13-9(14(18)19)5-7-21-13/h1-5,7H,6,8H2,(H,16,17)(H,18,19)