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

Details

Stereochemistry ACHIRAL
Molecular Formula C16H21IN2O2
Molecular Weight 396.2557
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-(((2S)-1-ETHYL-2-PYRROLIDINYL)METHYL)-2,3-DIHYDRO-5-(IODO-123I)-7-BENZOFURANCARBOXAMIDE

SMILES

CCN1CCC[C@H]1CNC(=O)C2=CC([123I])=CC3=C2OCC3

InChI

InChIKey=SXAMDWYVBFWJLU-BGZCVSRHSA-N
InChI=1S/C16H21IN2O2/c1-2-19-6-3-4-13(19)10-18-16(20)14-9-12(17)8-11-5-7-21-15(11)14/h8-9,13H,2-7,10H2,1H3,(H,18,20)/t13-/m0/s1/i17-4

HIDE SMILES / InChI

Molecular Formula C16H21IN2O2
Molecular Weight 396.2557
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 Mon Mar 31 18:03:26 GMT 2025
Edited
by admin
on Mon Mar 31 18:03:26 GMT 2025
Record UNII
S64252ZK1V
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
7-BENZOFURANCARBOXAMIDE, N-(((2S)-1-ETHYL-2-PYRROLIDINYL)METHYL)-2,3-DIHYDRO-5-(IODO-123I)-
Preferred Name English
N-(((2S)-1-ETHYL-2-PYRROLIDINYL)METHYL)-2,3-DIHYDRO-5-(IODO-123I)-7-BENZOFURANCARBOXAMIDE
Common Name English
7-BENZOFURANCARBOXAMIDE, N-((1-ETHYL-2-PYRROLIDINYL)METHYL)-2,3-DIHYDRO-5-(IODO-123I)-, (S)-
Systematic Name English
Code System Code Type Description
PUBCHEM
119025738
Created by admin on Mon Mar 31 18:03:26 GMT 2025 , Edited by admin on Mon Mar 31 18:03:26 GMT 2025
PRIMARY
CAS
129693-77-2
Created by admin on Mon Mar 31 18:03:26 GMT 2025 , Edited by admin on Mon Mar 31 18:03:26 GMT 2025
PRIMARY
FDA UNII
S64252ZK1V
Created by admin on Mon Mar 31 18:03:26 GMT 2025 , Edited by admin on Mon Mar 31 18:03:26 GMT 2025
PRIMARY