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

Details

Stereochemistry ACHIRAL
Molecular Formula C21H24N2
Molecular Weight 304.4294
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of AVN-101

SMILES

Cc1ccc2c(c1)c3CN(C)CCc3n2CCc4ccccc4

InChI

InChIKey=IBUHDDLETPJVGP-UHFFFAOYSA-N
InChI=1S/C21H24N2/c1-16-8-9-20-18(14-16)19-15-22(2)12-11-21(19)23(20)13-10-17-6-4-3-5-7-17/h3-9,14H,10-13,15H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C21H24N2
Molecular Weight 304.4294
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Jun 26 11:22:03 UTC 2021
Edited
by admin
on Sat Jun 26 11:22:03 UTC 2021
Record UNII
6MHR5IV28S
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
AVN-101
Code English
AVN-101 FREE BASE
Code English
1H-PYRIDO(4,3-B)INDOLE, 2,3,4,5-TETRAHYDRO-2,8-DIMETHYL-5-(2-PHENYLETHYL)-
Systematic Name English
2,3,4,5-TETRAHYDRO-2,8-DIMETHYL-5-(2-PHENYLETHYL)-1H-PYRIDO(4,3-B)INDOLE
Systematic Name English
2,3,4,5-TETRAHYDRO-2,8-DIMETHYL-5-PHENETHYL-1H-PYRIDO(4,3-B)INDOLE
Systematic Name English
Code System Code Type Description
CAS
1025725-91-0
Created by admin on Sat Jun 26 11:22:03 UTC 2021 , Edited by admin on Sat Jun 26 11:22:03 UTC 2021
PRIMARY
PUBCHEM
42631003
Created by admin on Sat Jun 26 11:22:03 UTC 2021 , Edited by admin on Sat Jun 26 11:22:03 UTC 2021
PRIMARY
FDA UNII
6MHR5IV28S
Created by admin on Sat Jun 26 11:22:03 UTC 2021 , Edited by admin on Sat Jun 26 11:22:03 UTC 2021
PRIMARY
Related Record Type Details
TARGET -> INHIBITOR
SALT/SOLVATE -> PARENT
Related Record Type Details
ACTIVE MOIETY