2,5-DIHYDRO-3,6-BIS(4-(OCTADECYLTHIO)PHENYL)PYRROLO(3,4-C)PYRROLE-1,4-DIONE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C54H84N2O2S2
Molecular Weight	857.387
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2,5-DIHYDRO-3,6-BIS(4-(OCTADECYLTHIO)PHENYL)PYRROLO(3,4-C)PYRROLE-1,4-DIONE

Structure Search

SMILES

CCCCCCCCCCCCCCCCCCSC1=CC=C(C=C1)C2=C3C(=O)NC(=C3C(=O)N2)C4=CC=C(SCCCCCCCCCCCCCCCCCC)C=C4

InChI

InChIKey=FOTPMSCWVSZTND-UHFFFAOYSA-N

InChI=1S/C54H84N2O2S2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-43-59-47-39-35-45(36-40-47)51-49-50(54(58)55-51)52(56-53(49)57)46-37-41-48(42-38-46)60-44-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h35-42H,3-34,43-44H2,1-2H3,(H,55,58)(H,56,57)

HIDE SMILES / InChI

Molecular Formula	C54H84N2O2S2
Molecular Weight	857.387
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 `Mon Mar 31 21:32:12 GMT 2025` Edited by `admin` on `Mon Mar 31 21:32:12 GMT 2025`
Record UNII	UE8I077QZ1
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

PYRROLO(3,4-C)PYRROLE-1,4-DIONE, 2,5-DIHYDRO-3,6-BIS(4-(OCTADECYLTHIO)PHENYL)-

Preferred Name

English

2,5-DIHYDRO-3,6-BIS(4-(OCTADECYLTHIO)PHENYL)PYRROLO(3,4-C)PYRROLE-1,4-DIONE

Systematic Name

English

Classification Tree Code System Code

Food Contact Sustance Notif, (FCN No.)

FCN NO. 263