TETRASODIUM 4,4'-(CARBONYLBIS(IMINO-1H-PYRROLE-4,2-DIYLCARBONYLIMINO(1-METHYL-1H-PYRROLE-4,2-DIYL)CARBONYLIMINO))BIS-1,7-NAPHTHALENEDISULFONATE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C43H32N10O17S4.4Na
Molecular Weight	1180.99
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of TETRASODIUM 4,4'-(CARBONYLBIS(IMINO-1H-PYRROLE-4,2-DIYLCARBONYLIMINO(1-METHYL-1H-PYRROLE-4,2-DIYL)CARBONYLIMINO))BIS-1,7-NAPHTHALENEDISULFONATE

Structure Search

SMILES

[Na+].[Na+].[Na+].[Na+].CN1C=C(NC(=O)C2=CC(NC(=O)NC3=CNC(=C3)C(=O)NC4=CN(C)C(=C4)C(=O)NC5=C6C=CC(=CC6=C(C=C5)S([O-])(=O)=O)S([O-])(=O)=O)=CN2)C=C1C(=O)NC7=C8C=CC(=CC8=C(C=C7)S([O-])(=O)=O)S([O-])(=O)=O

InChI

InChIKey=QHDNOGPTZQFRDE-UHFFFAOYSA-J

InChI=1S/C43H36N10O17S4.4Na/c1-52-19-23(13-35(52)41(56)50-31-7-9-37(73(65,66)67)29-15-25(71(59,60)61)3-5-27(29)31)46-39(54)33-11-21(17-44-33)48-43(58)49-22-12-34(45-18-22)40(55)47-24-14-36(53(2)20-24)42(57)51-32-8-10-38(74(68,69)70)30-16-26(72(62,63)64)4-6-28(30)32;;;;/h3-20,44-45H,1-2H3,(H,46,54)(H,47,55)(H,50,56)(H,51,57)(H2,48,49,58)(H,59,60,61)(H,62,63,64)(H,65,66,67)(H,68,69,70);;;;/q;4*+1/p-4

HIDE SMILES / InChI

Molecular Formula	C43H32N10O17S4
Molecular Weight	1089.031
Charge	-4
Count

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

Molecular Formula	Na
Molecular Weight	22.9898
Charge	1
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 Dec 16 08:21:53 GMT 2023` Edited by `admin` on `Sat Dec 16 08:21:53 GMT 2023`
Record UNII	D6P8TK24QP
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

TETRASODIUM 4,4'-(CARBONYLBIS(IMINO-1H-PYRROLE-4,2-DIYLCARBONYLIMINO(1-METHYL-1H-PYRROLE-4,2-DIYL)CARBONYLIMINO))BIS-1,7-NAPHTHALENEDISULFONATE

Systematic Name

English

1,7-NAPHTHALENEDISULFONIC ACID, 4,4'-(CARBONYLBIS(IMINO-1H-PYRROLE-4,2-DIYLCARBONYLIMINO(1-METHYL-1H-PYRROLE-4,2-DIYL)CARBONYLIMINO))BIS-, TETRASODIUM SALT

Systematic Name

English

NSC-651016

Code

English

1,7-NAPHTHALENEDISULFONIC ACID, 4,4'-(CARBONYLBIS(IMINO-1H-PYRROLE-4,2-DIYLCARBONYLIMINO(1-METHYL-1H-PYRROLE-4,2-DIYL)CARBONYLIMINO))BIS-, SODIUM SALT (1:4)

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID00174972