N-(2-cyclohexylsulfanylethyl)-1-(3-phenylpropylsulfonyl)piperidine-4-carboxamide

Systemtic Name: N-(2-cyclohexylsulfanylethyl)-1-(3-phenylpropylsulfonyl)piperidine-4-carboxamide Openeye Name: N-(2-cyclohexylsulfanylethyl)-1-(3-phenylpropylsulfonyl)piperidine-4-carboxamide CAS Name: N-[2-(cyclohexylthio)ethyl]-1-(3-phenylpropylsulfonyl)-4-piperidinecarboxamide IUPAC Name: N-(2-cyclohexylsulfanylethyl)-1-(3-phenylpropylsulfonyl)piperidine-4-carboxamide Traditional Name: N-[2-(cyclohexylthio)ethyl]-1-(3-phenylpropylsulfonyl)isonipecotamide Formula: C23H36N2O3S2 MolecularWeight: 452.67354

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)SCCNC(=O)C2CCN(CC2)S(=O)(=O)CCCC3=CC=CC=C3

Isomeric SMILES

C1CCC(CC1)SCCNC(=O)C2CCN(CC2)S(=O)(=O)CCCC3=CC=CC=C3

InChI

InChI=1S/C23H36N2O3S2/c26-23(24-15-18-29-22-11-5-2-6-12-22)21-13-16-25(17-14-21)30(27,28)19-7-10-20-8-3-1-4-9-20/h1,3-4,8-9,21-22H,2,5-7,10-19H2,(H,24,26)