methyl 4-[2-[(4-chlorophenyl)methylsulfanyl]ethylcarbamoyl]benzoate

Systemtic Name: methyl 4-[2-[(4-chlorophenyl)methylsulfanyl]ethylcarbamoyl]benzoate Openeye Name: methyl 4-[2-[(4-chlorophenyl)methylsulfanyl]ethylcarbamoyl]benzoate CAS Name: 4-[[2-[(4-chlorophenyl)methylthio]ethylamino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-[(4-chlorophenyl)methylsulfanyl]ethylcarbamoyl]benzoate Traditional Name: 4-[2-[(4-chlorobenzyl)thio]ethylcarbamoyl]benzoic acid methyl ester Formula: C18H18ClNO3S MolecularWeight: 363.85842

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C(=O)NCCSCC2=CC=C(C=C2)Cl

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C(=O)NCCSCC2=CC=C(C=C2)Cl

InChI

InChI=1S/C18H18ClNO3S/c1-23-18(22)15-6-4-14(5-7-15)17(21)20-10-11-24-12-13-2-8-16(19)9-3-13/h2-9H,10-12H2,1H3,(H,20,21)