N-[(2S,3S)-3-(3-cyanophenyl)-4-(4-ethoxyphenyl)-2-butanyl]-2-methyl-2-[(5-methyl-2-pyridinyl)oxy]propanamide (Q6593964)

SCHEMBL14691563 (English)

21 September 2016

chemical formula

C₂₉H₃₃N₃O₃

1 reference

SCHEMBL14691563 (English)

21 September 2016

canonical SMILES

CCOC1=CC=C(C=C1)CC(C2=CC=CC(=C2)C#N)C(C)NC(=O)C(C)(C)OC3=NC=C(C=C3)C

1 reference

SCHEMBL14691563 (English)

21 September 2016

isomeric SMILES

CCOC1=CC=C(C=C1)C[C@@H](C2=CC=CC(=C2)C#N)[C@H](C)NC(=O)C(C)(C)OC3=NC=C(C=C3)C

1 reference

SCHEMBL14691563 (English)

InChI=1S/C29H33N3O3/c1-6-34-25-13-11-22(12-14-25)17-26(24-9-7-8-23(16-24)18-30)21(3)32-28(33)29(4,5)35-27-15-10-20(2)19-31-27/h7-16,19,21,26H,6,17H2,1-5H3,(H,32,33)/t21-,26+/m0/s1

21 September 2016

different from

MK-9470

0 references

Identifiers

InChI

1 reference

SCHEMBL14691563 (English)

JWBGLSNXGRDLKH-HFZDXXHNSA-N

21 September 2016

InChIKey

1 reference

SCHEMBL14691563 (English)

reason for deprecated rank

21 September 2016

CAS Registry Number

945850-36-2

applies to other chemical entity

intended subject of deprecated statement

[18F]-MK-9470

1 reference

imported from Wikimedia project

1 reference

1 reference

MK-9470 (English)

21 September 2016

2 references

SCHEMBL14691563 (English)