ethyl 4-[2-(phenylmethylsulfanyl)phenyl]carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-(phenylmethylsulfanyl)phenyl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-(2-benzylsulfanylbenzoyl)piperazine-1-carboxylate CAS Name: 4-[oxo-[2-(phenylmethylthio)phenyl]methyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(2-benzylsulfanylbenzoyl)piperazine-1-carboxylate Traditional Name: 4-[2-(benzylthio)benzoyl]piperazine-1-carboxylic acid ethyl ester Formula: C21H24N2O3S MolecularWeight: 384.49186

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2=CC=CC=C2SCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=CC=CC=C2SCC3=CC=CC=C3

InChI

InChI=1S/C21H24N2O3S/c1-2-26-21(25)23-14-12-22(13-15-23)20(24)18-10-6-7-11-19(18)27-16-17-8-4-3-5-9-17/h3-11H,2,12-16H2,1H3