Lanepitant

CAS Registry Number®

170566-84-4
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CAS Name

Lanepitant

Molecular Formula

C33H45N5O3

Molecular Mass

559.74

Cite this Page

Lanepitant.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=170566-84-4 (retrieved 2024-04-20) (CAS RN: 170566-84-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C33H45N5O3/c1-25(39)38(22-26-10-4-7-13-32(26)41-2)23-28(20-27-21-34-31-12-6-5-11-30(27)31)35-33(40)24-36-18-14-29(15-19-36)37-16-8-3-9-17-37/h4-7,10-13,21,28-29,34H,3,8-9,14-20,22-24H2,1-2H3,(H,35,40)/t28-/m1/s1

InChIKey

InChIKey=CVXJAPZTZWLRBP-MUUNZHRXSA-N

SMILES

C([C@H](CN(CC1=C(OC)C=CC=C1)C(C)=O)NC(CN2CCC(CC2)N3CCCCC3)=O)C=4C=5C(NC4)=CC=CC5

Canonical SMILES

O=C(NC(CC1=CNC=2C=CC=CC21)CN(C(=O)C)CC=3C=CC=CC3OC)CN4CCC(N5CCCCC5)CC4

Other Names for this Substance

  • [1,4′-Bipiperidine]-1′-acetamide, N-[(1R)-2-[acetyl[(2-methoxyphenyl)methyl]amino]-1-(1H-indol-3-ylmethyl)ethyl]-
  • [1,4′-Bipiperidine]-1′-acetamide, N-[2-[acetyl[(2-methoxyphenyl)methyl]amino]-1-(1H-indol-3-ylmethyl)ethyl]-, (R)-
  • N-[(1R)-2-[Acetyl[(2-methoxyphenyl)methyl]amino]-1-(1H-indol-3-ylmethyl)ethyl][1,4′-bipiperidine]-1′-acetamide
  • LY 303870
  • Lanepitant

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