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Substance Name: 3-(1,1'-Biphenyl)-4-yl-2,5-dihydro-6-(4-(octadecylthio)phenyl)-pyrrolo(3,4-C)pyrrole-1,4-dione
RN: 960522-89-8
UNII: G306C849QC
InChIKey: NYJLYPLYQOSAOY-UHFFFAOYSA-N

Classification Code

  • TSCA Flag P (a Commenced PMN (Premanufacture Notice) Substance)

Molecular Formula

  • C42-H52-N2-O2-S

Molecular Weight

  • 648.9508
 
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Names and Synonyms

Name of Substance

  • 3-(1,1'-Biphenyl)-4-yl-2,5-dihydro-6-(4-(octadecylthio)phenyl)-pyrrolo(3,4-C)pyrrole-1,4-dione

Synonym

  • UNII-G306C849QC

Systematic Name

  • Pyrrolo(3,4-c)pyrrole-1,4-dione, 3-(1,1'-biphenyl)-4-yl-2,5-dihydro-6-(4-(octadecylthio)phenyl)-

Registry Numbers

CAS Registry Number

  • 960522-89-8

FDA UNII

  • G306C849QC

System Generated Number

  • 0960522898

Structure Descriptors

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)

InChIKey

NYJLYPLYQOSAOY-UHFFFAOYSA-N

Smiles

CCCCCCCCCCCCCCCCCCSc1ccc(cc1)C2=C3C(=C(NC3=O)c4ccc(cc4)c5ccccc5)C(=O)N2