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

Details

Stereochemistry ABSOLUTE
Molecular Formula C30H38N4
Molecular Weight 454.6495
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BN-81674

SMILES

CCCCCC1(CCCCC)N[C@H](CC2=C1NC3=C2C=CC=C3)C4=NC=C(N4)C5=CC=CC=C5

InChI

InChIKey=DGSMSHNIDMODOQ-AREMUKBSSA-N
InChI=1S/C30H38N4/c1-3-5-12-18-30(19-13-6-4-2)28-24(23-16-10-11-17-25(23)32-28)20-26(34-30)29-31-21-27(33-29)22-14-8-7-9-15-22/h7-11,14-17,21,26,32,34H,3-6,12-13,18-20H2,1-2H3,(H,31,33)/t26-/m1/s1

HIDE SMILES / InChI

Molecular Formula C30H38N4
Molecular Weight 454.6495
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

PubMed

PubMed

TitleDatePubMed
Patents

Patents

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:35:29 GMT 2023
Edited
by admin
on Sat Dec 16 08:35:29 GMT 2023
Record UNII
AW987R473Z
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BN-81674
Common Name English
1H-PYRIDO(3,4-B)INDOLE, 2,3,4,9-TETRAHYDRO-1,1-DIPENTYL-3-(5-PHENYL-1H-IMIDAZOL-2-YL)-, (3R)-
Systematic Name English
1H-PYRIDO(3,4-B)INDOLE, 2,3,4,9-TETRAHYDRO-1,1-DIPENTYL-3-(4-PHENYL-1H-IMIDAZOL-2-YL)-, (3R)-
Systematic Name English
Code System Code Type Description
PUBCHEM
5311378
Created by admin on Sat Dec 16 08:35:29 GMT 2023 , Edited by admin on Sat Dec 16 08:35:29 GMT 2023
PRIMARY
FDA UNII
AW987R473Z
Created by admin on Sat Dec 16 08:35:29 GMT 2023 , Edited by admin on Sat Dec 16 08:35:29 GMT 2023
PRIMARY
CAS
252278-73-2
Created by admin on Sat Dec 16 08:35:29 GMT 2023 , Edited by admin on Sat Dec 16 08:35:29 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY