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

Details

Stereochemistry ABSOLUTE
Molecular Formula C23H23ClN6O2
Molecular Weight 452.913
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SUVOREXANT C-14

SMILES

C[C@@H]1CCN(CCN1[14C](=O)C2=C(C=CC(C)=C2)N3N=CC=N3)C4=NC5=C(O4)C=CC(Cl)=C5

InChI

InChIKey=JYTNQNCOQXFQPK-OMCSZEPGSA-N
InChI=1S/C23H23ClN6O2/c1-15-3-5-20(30-25-8-9-26-30)18(13-15)22(31)29-12-11-28(10-7-16(29)2)23-27-19-14-17(24)4-6-21(19)32-23/h3-6,8-9,13-14,16H,7,10-12H2,1-2H3/t16-/m1/s1/i22+2

HIDE SMILES / InChI

Molecular Formula C23H23ClN6O2
Molecular Weight 452.913
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 17:02:12 GMT 2023
Edited
by admin
on Fri Dec 15 17:02:12 GMT 2023
Record UNII
88D1JK8STQ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
SUVOREXANT C-14
Common Name English
Code System Code Type Description
PUBCHEM
131634420
Created by admin on Fri Dec 15 17:02:12 GMT 2023 , Edited by admin on Fri Dec 15 17:02:12 GMT 2023
PRIMARY
FDA UNII
88D1JK8STQ
Created by admin on Fri Dec 15 17:02:12 GMT 2023 , Edited by admin on Fri Dec 15 17:02:12 GMT 2023
PRIMARY