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

Details

Stereochemistry ACHIRAL
Molecular Formula C19H24N4O5S
Molecular Weight 420.483
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BM-613

SMILES

CCCCCNC(=O)NS(=O)(=O)C1=CC(=CC=C1NC2=CC=C(C)C=C2)[N+]([O-])=O

InChI

InChIKey=ZXEYXJKZEQUHBP-UHFFFAOYSA-N
InChI=1S/C19H24N4O5S/c1-3-4-5-12-20-19(24)22-29(27,28)18-13-16(23(25)26)10-11-17(18)21-15-8-6-14(2)7-9-15/h6-11,13,21H,3-5,12H2,1-2H3,(H2,20,22,24)

HIDE SMILES / InChI

Molecular Formula C19H24N4O5S
Molecular Weight 420.483
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
In vitro and in vivo pharmacological characterization of BM-613 [N-n-pentyl-N'-[2-(4'-methylphenylamino)-5-nitrobenzenesulfonyl]urea], a novel dual thromboxane synthase inhibitor and thromboxane receptor antagonist.
2005 Apr
Substance Class Chemical
Created
by admin
on Sat Dec 16 11:05:56 GMT 2023
Edited
by admin
on Sat Dec 16 11:05:56 GMT 2023
Record UNII
PB9LJH9R4Y
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BM-613
Common Name English
BENZENESULFONAMIDE, 2-((4-METHYLPHENYL)AMINO)-5-NITRO-N-((PENTYLAMINO)CARBONYL)-
Systematic Name English
Code System Code Type Description
CAS
284465-11-8
Created by admin on Sat Dec 16 11:05:56 GMT 2023 , Edited by admin on Sat Dec 16 11:05:56 GMT 2023
PRIMARY
PUBCHEM
11676121
Created by admin on Sat Dec 16 11:05:56 GMT 2023 , Edited by admin on Sat Dec 16 11:05:56 GMT 2023
PRIMARY
FDA UNII
PB9LJH9R4Y
Created by admin on Sat Dec 16 11:05:56 GMT 2023 , Edited by admin on Sat Dec 16 11:05:56 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY