7-[2-[(5-chloranylthiophen-2-yl)methylsulfanyl]ethanoylamino]heptanoic acid

Systemtic Name: 7-[2-[(5-chloranylthiophen-2-yl)methylsulfanyl]ethanoylamino]heptanoic acid Openeye Name: 7-[[2-[(5-chloro-2-thienyl)methylsulfanyl]acetyl]amino]heptanoic acid CAS Name: 7-[[2-[(5-chloro-2-thiophenyl)methylthio]-1-oxoethyl]amino]heptanoic acid IUPAC Name: 7-[[2-[(5-chlorothiophen-2-yl)methylsulfanyl]acetyl]amino]heptanoic acid Traditional Name: 7-[[2-[(5-chloro-2-thienyl)methylthio]acetyl]amino]enanthic acid Formula: C14H20ClNO3S2 MolecularWeight: 349.8965

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(SC(=C1)Cl)CSCC(=O)NCCCCCCC(=O)O

Isomeric SMILES

C1=C(SC(=C1)Cl)CSCC(=O)NCCCCCCC(=O)O

InChI

InChI=1S/C14H20ClNO3S2/c15-12-7-6-11(21-12)9-20-10-13(17)16-8-4-2-1-3-5-14(18)19/h6-7H,1-5,8-10H2,(H,16,17)(H,18,19)