methyl 2-[3-[(3,4-dichlorophenyl)methylsulfanyl]propanoylamino]benzoate

Systemtic Name: methyl 2-[3-[(3,4-dichlorophenyl)methylsulfanyl]propanoylamino]benzoate Openeye Name: methyl 2-[3-[(3,4-dichlorophenyl)methylsulfanyl]propanoylamino]benzoate CAS Name: 2-[[3-[(3,4-dichlorophenyl)methylthio]-1-oxopropyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[3-[(3,4-dichlorophenyl)methylsulfanyl]propanoylamino]benzoate Traditional Name: 2-[3-[(3,4-dichlorobenzyl)thio]propanoylamino]benzoic acid methyl ester Formula: C18H17Cl2NO3S MolecularWeight: 398.30348

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=O)CCSCC2=CC(=C(C=C2)Cl)Cl

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=O)CCSCC2=CC(=C(C=C2)Cl)Cl

InChI

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