(2S,4R)-N-(1,1-Dimethylethyl)-1-[(2R,3S)-3-[[2-(2,6-dimethylphenoxy)acetyl]amino]-2-hydroxy-4-phenylbutyl]-4-(4-pyridinylthio)-2-piperidinecarboxamide

CAS Registry Number®

154612-58-5

CAS Name

(2S,4R)-N-(1,1-Dimethylethyl)-1-[(2R,3S)-3-[[2-(2,6-dimethylphenoxy)acetyl]amino]-2-hydroxy-4-phenylbutyl]-4-(4-pyridinylthio)-2-piperidinecarboxamide

Molecular Formula

C35H46N4O4S

Molecular Mass

618.83

Cite this Page

(2S,4R)-N-(1,1-Dimethylethyl)-1-[(2R,3S)-3-[[2-(2,6-dimethylphenoxy)acetyl]amino]-2-hydroxy-4-phenylbutyl]-4-(4-pyridinylthio)-2-piperidinecarboxamide.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=154612-58-5 (retrieved 2025-02-19) (CAS RN: 154612-58-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C35H46N4O4S/c1-24-10-9-11-25(2)33(24)43-23-32(41)37-29(20-26-12-7-6-8-13-26)31(40)22-39-19-16-28(44-27-14-17-36-18-15-27)21-30(39)34(42)38-35(3,4)5/h6-15,17-18,28-31,40H,16,19-23H2,1-5H3,(H,37,41)(H,38,42)/t28-,29+,30+,31-/m1/s1

InChIKey

InChIKey=WVPSCZBMYQIZMS-QNRWOPMTSA-N

SMILES

C(NC(C)(C)C)(=O)[C@H]1N(C[C@H]([C@H](CC2=CC=CC=C2)NC(COC3=C(C)C=CC=C3C)=O)O)CC[C@@H](SC=4C=CN=CC4)C1

Canonical SMILES

O=C(NC(CC=1C=CC=CC1)C(O)CN2CCC(SC=3C=CN=CC3)CC2C(=O)NC(C)(C)C)COC=4C(=CC=CC4C)C

Other Names for this Substance

  • 2-Piperidinecarboxamide, N-(1,1-dimethylethyl)-1-[(2R,3S)-3-[[2-(2,6-dimethylphenoxy)acetyl]amino]-2-hydroxy-4-phenylbutyl]-4-(4-pyridinylthio)-, (2S,4R)-
  • 2-Piperidinecarboxamide, N-(1,1-dimethylethyl)-1-[3-[[(2,6-dimethylphenoxy)acetyl]amino]-2-hydroxy-4-phenylbutyl]-4-(4-pyridinylthio)-, [2S-[1(2S*,3R*),2α,4α]]-
  • 2-Piperidinecarboxamide, N-(1,1-dimethylethyl)-1-[(2R,3S)-3-[[(2,6-dimethylphenoxy)acetyl]amino]-2-hydroxy-4-phenylbutyl]-4-(4-pyridinylthio)-, (2S,4R)-
  • (2S,4R)-N-(1,1-Dimethylethyl)-1-[(2R,3S)-3-[[2-(2,6-dimethylphenoxy)acetyl]amino]-2-hydroxy-4-phenylbutyl]-4-(4-pyridinylthio)-2-piperidinecarboxamide
  • BILA 2185BS

CAS INSIGHTSTM
Lithium-ion battery