N,N'-(DITHIODI-2,1-ETHANEDIYL)BIS(1,3-DIHYDRO-1,3-DIOXO-2H-ISOINDOLE-2-PROPIONAMIDE)

Details

Stereochemistry	ACHIRAL
Molecular Formula	C26H26N4O6S2
Molecular Weight	554.638
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of N,N'-(DITHIODI-2,1-ETHANEDIYL)BIS(1,3-DIHYDRO-1,3-DIOXO-2H-ISOINDOLE-2-PROPIONAMIDE)

Structure Search

SMILES

O=C(CCN1C(=O)C2=C(C=CC=C2)C1=O)NCCSSCCNC(=O)CCN3C(=O)C4=C(C=CC=C4)C3=O

InChI

InChIKey=QLMHYXYANMYGEH-UHFFFAOYSA-N

InChI=1S/C26H26N4O6S2/c31-21(9-13-29-23(33)17-5-1-2-6-18(17)24(29)34)27-11-15-37-38-16-12-28-22(32)10-14-30-25(35)19-7-3-4-8-20(19)26(30)36/h1-8H,9-16H2,(H,27,31)(H,28,32)

HIDE SMILES / InChI

Molecular Formula	C26H26N4O6S2
Molecular Weight	554.638
Charge	0
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 12:02:50 GMT 2023` Edited by `admin` on `Sat Dec 16 12:02:50 GMT 2023`
Record UNII	9JC5I7TKQ1
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

N,N'-(DITHIODI-2,1-ETHANEDIYL)BIS(1,3-DIHYDRO-1,3-DIOXO-2H-ISOINDOLE-2-PROPIONAMIDE)

Systematic Name

English

3-(1,3-DIOXOISOINDOL-2-YL)-N-(2-(2-(3-(1,3-DIOXOISOINDOL-2-YL)PROPANOYLAMINO)ETHYLDISULFANYL)ETHYL)PROPANAMIDE

Systematic Name

English

2H-ISOINDOLE-2-PROPANAMIDE, N,N'-(DITHIODI-2,1-ETHANEDIYL)BIS(1,3-DIHYDRO-1,3-DIOXO-

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID90236371