1-[2-[(5-chloranylthiophen-2-yl)methylsulfanyl]ethanoylamino]cyclopentane-1-carboxylic acid

Systemtic Name: 1-[2-[(5-chloranylthiophen-2-yl)methylsulfanyl]ethanoylamino]cyclopentane-1-carboxylic acid Openeye Name: 1-[[2-[(5-chloro-2-thienyl)methylsulfanyl]acetyl]amino]cyclopentanecarboxylic acid CAS Name: 1-[[2-[(5-chloro-2-thiophenyl)methylthio]-1-oxoethyl]amino]-1-cyclopentanecarboxylic acid IUPAC Name: 1-[[2-[(5-chlorothiophen-2-yl)methylsulfanyl]acetyl]amino]cyclopentane-1-carboxylic acid Traditional Name: 1-[[2-[(5-chloro-2-thienyl)methylthio]acetyl]amino]cyclopentanecarboxylic acid Formula: C13H16ClNO3S2 MolecularWeight: 333.85404

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)(C(=O)O)NC(=O)CSCC2=CC=C(S2)Cl

Isomeric SMILES

C1CCC(C1)(C(=O)O)NC(=O)CSCC2=CC=C(S2)Cl

InChI

InChI=1S/C13H16ClNO3S2/c14-10-4-3-9(20-10)7-19-8-11(16)15-13(12(17)18)5-1-2-6-13/h3-4H,1-2,5-8H2,(H,15,16)(H,17,18)