1-[(2-methylphenyl)methylsulfonyl]-N-[2-(phenylmethylsulfanyl)ethyl]piperidine-4-carboxamide

Systemtic Name: 1-[(2-methylphenyl)methylsulfonyl]-N-[2-(phenylmethylsulfanyl)ethyl]piperidine-4-carboxamide Openeye Name: N-(2-benzylsulfanylethyl)-1-(o-tolylmethylsulfonyl)piperidine-4-carboxamide CAS Name: 1-[(2-methylphenyl)methylsulfonyl]-N-[2-(phenylmethylthio)ethyl]-4-piperidinecarboxamide IUPAC Name: N-(2-benzylsulfanylethyl)-1-[(2-methylphenyl)methylsulfonyl]piperidine-4-carboxamide Traditional Name: N-[2-(benzylthio)ethyl]-1-(2-methylbenzyl)sulfonyl-isonipecotamide Formula: C23H30N2O3S2 MolecularWeight: 446.6259

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CS(=O)(=O)N2CCC(CC2)C(=O)NCCSCC3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC=C1CS(=O)(=O)N2CCC(CC2)C(=O)NCCSCC3=CC=CC=C3

InChI

InChI=1S/C23H30N2O3S2/c1-19-7-5-6-10-22(19)18-30(27,28)25-14-11-21(12-15-25)23(26)24-13-16-29-17-20-8-3-2-4-9-20/h2-10,21H,11-18H2,1H3,(H,24,26)