(3,4-dichlorophenyl)methyl 2-benzamido-4-methylsulfanyl-butanoate

Systemtic Name: (3,4-dichlorophenyl)methyl 2-benzamido-4-methylsulfanyl-butanoate Openeye Name: (3,4-dichlorophenyl)methyl 2-benzamido-4-methylsulfanyl-butanoate CAS Name: 2-benzamido-4-(methylthio)butanoic acid (3,4-dichlorophenyl)methyl ester IUPAC Name: (3,4-dichlorophenyl)methyl 2-benzamido-4-methylsulfanylbutanoate Traditional Name: 2-benzamido-4-(methylthio)butyric acid (3,4-dichlorobenzyl) ester Formula: C19H19Cl2NO3S MolecularWeight: 412.33006

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)OCC1=CC(=C(C=C1)Cl)Cl)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CSCCC(C(=O)OCC1=CC(=C(C=C1)Cl)Cl)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C19H19Cl2NO3S/c1-26-10-9-17(22-18(23)14-5-3-2-4-6-14)19(24)25-12-13-7-8-15(20)16(21)11-13/h2-8,11,17H,9-10,12H2,1H3,(H,22,23)