5-[3-(2-chlorophenyl)sulfanylpropanoylamino]thiophene-2-carboxylic acid

Systemtic Name: 5-[3-(2-chlorophenyl)sulfanylpropanoylamino]thiophene-2-carboxylic acid Openeye Name: 5-[3-(2-chlorophenyl)sulfanylpropanoylamino]thiophene-2-carboxylic acid CAS Name: 5-[[3-[(2-chlorophenyl)thio]-1-oxopropyl]amino]-2-thiophenecarboxylic acid IUPAC Name: 5-[3-(2-chlorophenyl)sulfanylpropanoylamino]thiophene-2-carboxylic acid Traditional Name: 5-[3-[(2-chlorophenyl)thio]propanoylamino]-2-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=CC=C(S2)C(=O)O)Cl

Isomeric SMILES

C1=CC=C(C(=C1)SCCC(=O)NC2=CC=C(S2)C(=O)O)Cl

InChI

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