NF-676

Details

Stereochemistry	ACHIRAL
Molecular Formula	C41H28N8O9S2.2Na
Molecular Weight	886.819
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[Na+].[Na+].[O-]S(=O)(=O)C1=CC=C(NC(=O)C2=CC3=C(NC(=N3)C4=CC=C(NC(=O)NC5=CC=C(C=C5)C6=NC7=C(N6)C=CC(=C7)C(=O)NC8=CC=C(C=C8)S([O-])(=O)=O)C=C4)C=C2)C=C1

InChI

InChIKey=QHVRJOAEIPEHDT-UHFFFAOYSA-L

InChI=1S/C41H30N8O9S2.2Na/c50-39(42-27-11-15-31(16-12-27)59(53,54)55)25-5-19-33-35(21-25)48-37(46-33)23-1-7-29(8-2-23)44-41(52)45-30-9-3-24(4-10-30)38-47-34-20-6-26(22-36(34)49-38)40(51)43-28-13-17-32(18-14-28)60(56,57)58;;/h1-22H,(H,42,50)(H,43,51)(H,46,48)(H,47,49)(H2,44,45,52)(H,53,54,55)(H,56,57,58);;/q;2*+1/p-2

HIDE SMILES / InChI

Molecular Formula	Na
Molecular Weight	22.98976928
Charge	1
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	C41H28N8O9S2
Molecular Weight	840.839
Charge	-2
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 `Mon Mar 31 22:25:19 GMT 2025` Edited by `admin` on `Mon Mar 31 22:25:19 GMT 2025`
Record UNII	TX58P9Y5GK
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

BENZENESULFONIC ACID, 4,4'-(CARBONYLBIS(IMINO-4,1-PHENYLENE-1H-BENZIMIDAZOLE-2,5-DIYLCARBONYLIMINO))BIS-, DISODIUM SALT

Preferred Name

English

NF-676

Common Name

English

NF676

Code

English

Code System Code Type Description

FDA UNII

TX58P9Y5GK

Created by admin on Mon Mar 31 22:25:19 GMT 2025 , Edited by admin on Mon Mar 31 22:25:19 GMT 2025

PRIMARY

PUBCHEM

11506152

Created by admin on Mon Mar 31 22:25:19 GMT 2025 , Edited by admin on Mon Mar 31 22:25:19 GMT 2025

PRIMARY

CAS

869111-50-2

Created by admin on Mon Mar 31 22:25:19 GMT 2025 , Edited by admin on Mon Mar 31 22:25:19 GMT 2025

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