methyl 4-[2-[(3-chlorophenyl)methylsulfanyl]ethanoyl]piperazine-1-carboxylate

Systemtic Name: methyl 4-[2-[(3-chlorophenyl)methylsulfanyl]ethanoyl]piperazine-1-carboxylate Openeye Name: methyl 4-[2-[(3-chlorophenyl)methylsulfanyl]acetyl]piperazine-1-carboxylate CAS Name: 4-[2-[(3-chlorophenyl)methylthio]-1-oxoethyl]-1-piperazinecarboxylic acid methyl ester IUPAC Name: methyl 4-[2-[(3-chlorophenyl)methylsulfanyl]acetyl]piperazine-1-carboxylate Traditional Name: 4-[2-[(3-chlorobenzyl)thio]acetyl]piperazine-1-carboxylic acid methyl ester Formula: C15H19ClN2O3S MolecularWeight: 342.84096

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)N1CCN(CC1)C(=O)CSCC2=CC(=CC=C2)Cl

Isomeric SMILES

COC(=O)N1CCN(CC1)C(=O)CSCC2=CC(=CC=C2)Cl

InChI

InChI=1S/C15H19ClN2O3S/c1-21-15(20)18-7-5-17(6-8-18)14(19)11-22-10-12-3-2-4-13(16)9-12/h2-4,9H,5-8,10-11H2,1H3