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Substance Name: 3'-(N-methyl-1,4-nicotinoyl)-5'-pivaloyltrifluorothymidine
RN: 104987-44-2
InChIKey: PUUXKDCZTQOAGJ-QMRHZFGWSA-N

Molecular Formula

  • C22-H26-F3-N3-O7

Molecular Weight

  • 501.455
 
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Names and Synonyms

Name of Substance

  • 3'-(N-methyl-1,4-nicotinoyl)-5'-pivaloyltrifluorothymidine

Synonym

  • DHTFT

Systematic Name

  • Thymidine, alpha,alpha,alpha-trifluoro-, 3'-(1,4-dihydro-1-methyl-3-pyridinecarboxylate) 5'-(2,2-dimethylpropanoate)

Registry Numbers

CAS Registry Number

  • 104987-44-2

System Generated Number

  • 0104987442

Structure Descriptors

InChI

1S/C22H26F3N3O7/c1-21(2,3)19(31)33-11-15-14(35-18(30)12-6-5-7-27(4)9-12)8-16(34-15)28-10-13(22(23,24)25)17(29)26-20(28)32/h5,7,9-10,14-16H,6,8,11H2,1-4H3,(H,26,29,32)/t14-,15+,16?/m0/s1

InChIKey

PUUXKDCZTQOAGJ-QMRHZFGWSA-N

Smiles

c1([nH]c([n@]([C@@H]2C[C@@H]([C@H](O2)COC(C(C)(C)C)=O)OC(C2=CN(C=CC2)C)=O)cc1C(F)(F)F)=O)=O