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Details

Stereochemistry ACHIRAL
Molecular Formula C20H28N4
Molecular Weight 324.4631
Optical Activity NONE
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of (3-endo)-3-[3-Methyl-5-(1-methylethyl)-4H-1,2,4-triazol-4-yl]-8-(phenylmethyl)-8-azabicyclo[3.2.1]octane

SMILES

CC(C)C1=NN=C(C)N1[C@@H]2C[C@@H]3CC[C@H](C2)N3CC4=CC=CC=C4

InChI

InChIKey=YHGHRIAZABSSGB-BWTSREIZSA-N
InChI=1S/C20H28N4/c1-14(2)20-22-21-15(3)24(20)19-11-17-9-10-18(12-19)23(17)13-16-7-5-4-6-8-16/h4-8,14,17-19H,9-13H2,1-3H3/t17-,18+,19+

HIDE SMILES / InChI

Molecular Formula C20H28N4
Molecular Weight 324.4631
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 19:33:38 GMT 2025
Edited
by admin
on Wed Apr 02 19:33:38 GMT 2025
Record UNII
C6GB2T8G7Z
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(3-endo)-3-[3-Methyl-5-(1-methylethyl)-4H-1,2,4-triazol-4-yl]-8-(phenylmethyl)-8-azabicyclo[3.2.1]octane
Systematic Name English
8-Azabicyclo[3.2.1]octane, 3-[3-methyl-5-(1-methylethyl)-4H-1,2,4-triazol-4-yl]-8-(phenylmethyl)-, (3-endo)-
Preferred Name English
Code System Code Type Description
FDA UNII
C6GB2T8G7Z
Created by admin on Wed Apr 02 19:33:38 GMT 2025 , Edited by admin on Wed Apr 02 19:33:38 GMT 2025
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CAS
858651-22-6
Created by admin on Wed Apr 02 19:33:38 GMT 2025 , Edited by admin on Wed Apr 02 19:33:38 GMT 2025
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