methyl 4-[2-[(3-chlorophenyl)methylsulfanyl]ethanoylamino]benzoate

Systemtic Name: methyl 4-[2-[(3-chlorophenyl)methylsulfanyl]ethanoylamino]benzoate Openeye Name: methyl 4-[[2-[(3-chlorophenyl)methylsulfanyl]acetyl]amino]benzoate CAS Name: 4-[[2-[(3-chlorophenyl)methylthio]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-[(3-chlorophenyl)methylsulfanyl]acetyl]amino]benzoate Traditional Name: 4-[[2-[(3-chlorobenzyl)thio]acetyl]amino]benzoic acid methyl ester Formula: C17H16ClNO3S MolecularWeight: 349.83184

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16ClNO3S/c1-22-17(21)13-5-7-15(8-6-13)19-16(20)11-23-10-12-3-2-4-14(18)9-12/h2-9H,10-11H2,1H3,(H,19,20)