N-[2-(phenylmethylsulfanyl)ethyl]-1-(3-phenylpropylsulfonyl)piperidine-4-carboxamide

Systemtic Name: N-[2-(phenylmethylsulfanyl)ethyl]-1-(3-phenylpropylsulfonyl)piperidine-4-carboxamide Openeye Name: N-(2-benzylsulfanylethyl)-1-(3-phenylpropylsulfonyl)piperidine-4-carboxamide CAS Name: N-[2-(phenylmethylthio)ethyl]-1-(3-phenylpropylsulfonyl)-4-piperidinecarboxamide IUPAC Name: N-(2-benzylsulfanylethyl)-1-(3-phenylpropylsulfonyl)piperidine-4-carboxamide Traditional Name: N-[2-(benzylthio)ethyl]-1-(3-phenylpropylsulfonyl)isonipecotamide Formula: C24H32N2O3S2 MolecularWeight: 460.65248

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCCSCC2=CC=CC=C2)S(=O)(=O)CCCC3=CC=CC=C3

Isomeric SMILES

C1CN(CCC1C(=O)NCCSCC2=CC=CC=C2)S(=O)(=O)CCCC3=CC=CC=C3

InChI

InChI=1S/C24H32N2O3S2/c27-24(25-15-18-30-20-22-10-5-2-6-11-22)23-13-16-26(17-14-23)31(28,29)19-7-12-21-8-3-1-4-9-21/h1-6,8-11,23H,7,12-20H2,(H,25,27)