U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C23H42N4O5
Molecular Weight 454.6034
Optical Activity NONE
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1,1-Dimethylethyl N-[trans-4-[[[[trans-4-[[(1,1-dimethylethoxy)carbonyl]amino]cyclohexyl]amino]carbonyl]amino]cyclohexyl]carbamate

SMILES

CC(C)(C)OC(=O)N[C@H]1CC[C@@H](CC1)NC(=O)N[C@H]2CC[C@@H](CC2)NC(=O)OC(C)(C)C

InChI

InChIKey=JYKXKGJCZZXHON-OPMHRUBESA-N
InChI=1S/C23H42N4O5/c1-22(2,3)31-20(29)26-17-11-7-15(8-12-17)24-19(28)25-16-9-13-18(14-10-16)27-21(30)32-23(4,5)6/h15-18H,7-14H2,1-6H3,(H,26,29)(H,27,30)(H2,24,25,28)/t15-,16-,17-,18-

HIDE SMILES / InChI

Molecular Formula C23H42N4O5
Molecular Weight 454.6034
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 19:19:23 GMT 2025
Edited
by admin
on Wed Apr 02 19:19:23 GMT 2025
Record UNII
5Q7P6M2N7F
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Carbamic acid, N-[trans-4-[[[[trans-4-[[(1,1-dimethylethoxy)carbonyl]amino]cyclohexyl]amino]carbonyl]amino]cyclohexyl]-, 1,1-dimethylethyl ester
Preferred Name English
1,1-Dimethylethyl N-[trans-4-[[[[trans-4-[[(1,1-dimethylethoxy)carbonyl]amino]cyclohexyl]amino]carbonyl]amino]cyclohexyl]carbamate
Systematic Name English
Code System Code Type Description
FDA UNII
5Q7P6M2N7F
Created by admin on Wed Apr 02 19:19:23 GMT 2025 , Edited by admin on Wed Apr 02 19:19:23 GMT 2025
PRIMARY
CAS
1056938-73-8
Created by admin on Wed Apr 02 19:19:23 GMT 2025 , Edited by admin on Wed Apr 02 19:19:23 GMT 2025
PRIMARY