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Substance Name: (Z)-2-(4-(3-(2-(Trifluoromethyl)-9H-thioxanthen-9-ylidene)propyl)-1-piperazinyl)ethyl oleate
RN: 85721-06-8
InChIKey: VJGPTRNEXYYOBB-QKCKFDDGSA-N

Molecular Formula

  • C41-H57-F3-N2-O2-S

Molecular Weight

  • 698.9733
 
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Names and Synonyms

Synonym

  • EINECS 288-416-0

Systematic Name

  • (Z)-2-(4-(3-(2-(Trifluoromethyl)-9H-thioxanthen-9-ylidene)propyl)-1-piperazinyl)ethyl oleate

Registry Numbers

CAS Registry Number

  • 85721-06-8

System Generated Number

  • 0085721068

Structure Descriptors

InChI

1S/C41H57F3N2O2S/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-23-37(40(47)48-4-2)46-30-28-45(29-31-46)27-20-22-34-35-21-18-19-24-38(35)49-39-26-25-33(32-36(34)39)41(42,43)44/h11-12,18-19,21-22,24-26,32,37H,3-10,13-17,20,23,27-31H2,1-2H3/b12-11-,34-22-

InChIKey

VJGPTRNEXYYOBB-QKCKFDDGSA-N

Smiles

CCCCCCCC/C=C\CCCCCCC(C(=O)OCC)N1CCN(CC1)CC/C=C\2/c3ccccc3Sc4c2cc(cc4)C(F)(F)F