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

Systemtic Name: 1-[2-[(5-chloranylthiophen-2-yl)methylsulfanyl]ethanoylamino]cyclohexane-1-carboxylic acid Openeye Name: 1-[[2-[(5-chloro-2-thienyl)methylsulfanyl]acetyl]amino]cyclohexanecarboxylic acid CAS Name: 1-[[2-[(5-chloro-2-thiophenyl)methylthio]-1-oxoethyl]amino]-1-cyclohexanecarboxylic acid IUPAC Name: 1-[[2-[(5-chlorothiophen-2-yl)methylsulfanyl]acetyl]amino]cyclohexane-1-carboxylic acid Traditional Name: 1-[[2-[(5-chloro-2-thienyl)methylthio]acetyl]amino]cyclohexanecarboxylic acid Formula: C14H18ClNO3S2 MolecularWeight: 347.88062

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(C(=O)O)NC(=O)CSCC2=CC=C(S2)Cl

Isomeric SMILES

C1CCC(CC1)(C(=O)O)NC(=O)CSCC2=CC=C(S2)Cl

InChI

InChI=1S/C14H18ClNO3S2/c15-11-5-4-10(21-11)8-20-9-12(17)16-14(13(18)19)6-2-1-3-7-14/h4-5H,1-3,6-9H2,(H,16,17)(H,18,19)