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

Details

Stereochemistry ABSOLUTE
Molecular Formula C32H28N6O8
Molecular Weight 624.6001
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BISNAFIDE

SMILES

C[C@H](CNCCNC[C@@H](C)N1C(=O)C2=CC=CC3=CC(=CC(C1=O)=C23)[N+]([O-])=O)N4C(=O)C5=CC=CC6=CC(=CC(C4=O)=C56)[N+]([O-])=O

InChI

InChIKey=PXBZKHOQHTVCSQ-QZTJIDSGSA-N
InChI=1S/C32H28N6O8/c1-17(35-29(39)23-7-3-5-19-11-21(37(43)44)13-25(27(19)23)31(35)41)15-33-9-10-34-16-18(2)36-30(40)24-8-4-6-20-12-22(38(45)46)14-26(28(20)24)32(36)42/h3-8,11-14,17-18,33-34H,9-10,15-16H2,1-2H3/t17-,18-/m1/s1

HIDE SMILES / InChI

Molecular Formula C32H28N6O8
Molecular Weight 624.6001
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 16:57:22 UTC 2023
Edited
by admin
on Sat Dec 16 16:57:22 UTC 2023
Record UNII
62H4W26906
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BISNAFIDE
INN   WHO-DD  
INN  
Official Name English
Bisnafide [WHO-DD]
Common Name English
bisnafide [INN]
Common Name English
1H-BENZ(DE)ISOQUINOLINE-1,3(2H)-DIONE, 2,2'-(1,2-ETHANEDIYLBIS(IMINO((1R)-1-METHYL-2,1-ETHANEDIYL)))BIS(5-NITRO-
Common Name English
N,N'-(ETHYLENEBIS(IMINO((R)-1-METHYLETHYLENE)))BIS(3-NITRONAPHTHALIMIDE)
Common Name English
1H-BENZ(DE)ISOQUINOLINE-1,3(2H)-DIONE, 2,2'-(1,2-ETHANEDIYLBIS(IMINO(1-METHYL-2,1-ETHANEDIYL)))BIS(5-NITRO-, (R-(R*,R*))-
Common Name English
VERSALUMA
Brand Name English
Classification Tree Code System Code
NCI_THESAURUS C582
Created by admin on Sat Dec 16 16:57:22 UTC 2023 , Edited by admin on Sat Dec 16 16:57:22 UTC 2023
Code System Code Type Description
INN
7368
Created by admin on Sat Dec 16 16:57:22 UTC 2023 , Edited by admin on Sat Dec 16 16:57:22 UTC 2023
PRIMARY
PUBCHEM
60917
Created by admin on Sat Dec 16 16:57:22 UTC 2023 , Edited by admin on Sat Dec 16 16:57:22 UTC 2023
PRIMARY
FDA UNII
62H4W26906
Created by admin on Sat Dec 16 16:57:22 UTC 2023 , Edited by admin on Sat Dec 16 16:57:22 UTC 2023
PRIMARY
ChEMBL
CHEMBL1178861
Created by admin on Sat Dec 16 16:57:22 UTC 2023 , Edited by admin on Sat Dec 16 16:57:22 UTC 2023
PRIMARY
MESH
C084899
Created by admin on Sat Dec 16 16:57:22 UTC 2023 , Edited by admin on Sat Dec 16 16:57:22 UTC 2023
PRIMARY
CAS
144849-63-8
Created by admin on Sat Dec 16 16:57:22 UTC 2023 , Edited by admin on Sat Dec 16 16:57:22 UTC 2023
PRIMARY
SMS_ID
100000086320
Created by admin on Sat Dec 16 16:57:22 UTC 2023 , Edited by admin on Sat Dec 16 16:57:22 UTC 2023
PRIMARY
NCI_THESAURUS
C73611
Created by admin on Sat Dec 16 16:57:22 UTC 2023 , Edited by admin on Sat Dec 16 16:57:22 UTC 2023
PRIMARY
EVMPD
SUB05853MIG
Created by admin on Sat Dec 16 16:57:22 UTC 2023 , Edited by admin on Sat Dec 16 16:57:22 UTC 2023
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT
Related Record Type Details
ACTIVE MOIETY