methyl 4-[2-[2-[(5-chloranylthiophen-2-yl)methylsulfanyl]ethanoyloxy]ethanoylamino]benzoate

Systemtic Name: methyl 4-[2-[2-[(5-chloranylthiophen-2-yl)methylsulfanyl]ethanoyloxy]ethanoylamino]benzoate Openeye Name: methyl 4-[[2-[2-[(5-chloro-2-thienyl)methylsulfanyl]acetyl]oxyacetyl]amino]benzoate CAS Name: 4-[[2-[2-[(5-chloro-2-thiophenyl)methylthio]-1-oxoethoxy]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-[2-[(5-chlorothiophen-2-yl)methylsulfanyl]acetyl]oxyacetyl]amino]benzoate Traditional Name: 4-[[2-[2-[(5-chloro-2-thienyl)methylthio]acetyl]oxyacetyl]amino]benzoic acid methyl ester Formula: C17H16ClNO5S2 MolecularWeight: 413.89564

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16ClNO5S2/c1-23-17(22)11-2-4-12(5-3-11)19-15(20)8-24-16(21)10-25-9-13-6-7-14(18)26-13/h2-7H,8-10H2,1H3,(H,19,20)