3-[2-[(3-chlorophenyl)methylsulfanyl]ethanoylamino]thiophene-2-carboxylic acid

Systemtic Name: 3-[2-[(3-chlorophenyl)methylsulfanyl]ethanoylamino]thiophene-2-carboxylic acid Openeye Name: 3-[[2-[(3-chlorophenyl)methylsulfanyl]acetyl]amino]thiophene-2-carboxylic acid CAS Name: 3-[[2-[(3-chlorophenyl)methylthio]-1-oxoethyl]amino]-2-thiophenecarboxylic acid IUPAC Name: 3-[[2-[(3-chlorophenyl)methylsulfanyl]acetyl]amino]thiophene-2-carboxylic acid Traditional Name: 3-[[2-[(3-chlorobenzyl)thio]acetyl]amino]-2-thenoic acid Formula: C14H12ClNO3S2 MolecularWeight: 341.83298

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)CSCC(=O)NC2=C(SC=C2)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)Cl)CSCC(=O)NC2=C(SC=C2)C(=O)O

InChI

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