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Substance Name: 2,9-Bis(3-mercaptophenyl)anthra(2,1,9-def:6,5,10-d'e'f')diisoquinoline-1,3,8,10(2H,9H)-tetrone
RN: 94094-81-2
InChIKey: QYJNEVWQFXXWNF-UHFFFAOYSA-N

Molecular Formula

  • C36-H18-N2-O4-S2

Molecular Weight

  • 606.6802
 
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Names and Synonyms

Synonym

  • EINECS 302-183-5

Systematic Name

  • 2,9-Bis(3-mercaptophenyl)anthra(2,1,9-def:6,5,10-d'e'f')diisoquinoline-1,3,8,10(2H,9H)-tetrone

Registry Numbers

CAS Registry Number

  • 94094-81-2

System Generated Number

  • 0094094812

Structure Descriptors

InChI

1S/C36H18N2O4S2/c39-33-25-11-7-21-23-9-13-27-32-28(36(42)38(35(27)41)18-4-2-6-20(44)16-18)14-10-24(30(23)32)22-8-12-26(31(25)29(21)22)34(40)37(33)17-3-1-5-19(43)15-17/h1-16,43-44H

InChIKey

QYJNEVWQFXXWNF-UHFFFAOYSA-N

Smiles

c1cc(cc(c1)S)N2C(=O)c3ccc4c5ccc6c7c5c(ccc7C(=O)N(C6=O)c8cccc(c8)S)c9c4c3c(cc9)C2=O