methyl 4-[[2-[(2,4-dichlorophenyl)methylsulfanyl]ethanoylamino]methyl]benzoate

Systemtic Name: methyl 4-[[2-[(2,4-dichlorophenyl)methylsulfanyl]ethanoylamino]methyl]benzoate Openeye Name: methyl 4-[[[2-[(2,4-dichlorophenyl)methylsulfanyl]acetyl]amino]methyl]benzoate CAS Name: 4-[[[2-[(2,4-dichlorophenyl)methylthio]-1-oxoethyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[2-[(2,4-dichlorophenyl)methylsulfanyl]acetyl]amino]methyl]benzoate Traditional Name: 4-[[[2-[(2,4-dichlorobenzyl)thio]acetyl]amino]methyl]benzoic acid methyl ester Formula: C18H17Cl2NO3S MolecularWeight: 398.30348

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CNC(=O)CSCC2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CNC(=O)CSCC2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C18H17Cl2NO3S/c1-24-18(23)13-4-2-12(3-5-13)9-21-17(22)11-25-10-14-6-7-15(19)8-16(14)20/h2-8H,9-11H2,1H3,(H,21,22)