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

Details

Stereochemistry	ACHIRAL
Molecular Formula	C42H52N2O2S
Molecular Weight	648.939
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3-(1,1'-BIPHENYL)-4-YL-2,5-DIHYDRO-6-(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(C=C4)C5=CC=CC=C5

InChI

InChIKey=NYJLYPLYQOSAOY-UHFFFAOYSA-N

InChI=1S/C42H52N2O2S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-31-47-36-29-27-35(28-30-36)40-38-37(41(45)44-40)39(43-42(38)46)34-25-23-33(24-26-34)32-21-18-17-19-22-32/h17-19,21-30H,2-16,20,31H2,1H3,(H,43,46)(H,44,45)

HIDE SMILES / InChI

Molecular Formula	C42H52N2O2S
Molecular Weight	648.939
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 22:02:51 GMT 2025` Edited by `admin` on `Mon Mar 31 22:02:51 GMT 2025`
Record UNII	G306C849QC
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

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

Preferred Name

English

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

Systematic Name

English

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

Systematic Name

English

Classification Tree Code System Code

Food Contact Sustance Notif, (FCN No.)

FCN NO. 892