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Substance Name: (4R,5R,6R)-Tetrahydro-1,3-bis((3-(N-hydroxycarboximidamide)-phenyl)methyl)-5-hydroxy-4-(2-(4-fluorophenyl)ethyl)-6-(4-fluorophenylmethyl)-2(1H)-pyrimidinone
RN: 167824-24-0
InChIKey: GNPYXBMOZFIQNG-IWWXRALLSA-N

Molecular Formula

  • C35-H36-F2-N6-O4

Molecular Weight

  • 642.7034
 
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Names and Synonyms

  • (4R,5R,6R)-Tetrahydro-1,3-bis((3-(N-hydroxycarboximidamide)-phenyl)methyl)-5-hydroxy-4-(2-(4-fluorophenyl)ethyl)-6-(4-fluorophenylmethyl)-2(1H)-pyrimidinone

Registry Numbers

CAS Registry Number

  • 167824-24-0

System Generated Number

  • 0167824240

Structure Descriptors

InChI

1S/C35H36F2N6O4/c36-28-12-7-22(8-13-28)11-16-30-32(44)31(19-23-9-14-29(37)15-10-23)43(21-25-4-2-6-27(18-25)34(39)41-47)35(45)42(30)20-24-3-1-5-26(17-24)33(38)40-46/h1-10,12-15,17-18,30-32,44,46-47H,11,16,19-21H2,(H2,38,40)(H2,39,41)/t30-,31-,32+/m1/s1

InChIKey

GNPYXBMOZFIQNG-IWWXRALLSA-N

Smiles

c1cc(cc(c1)/C(=N\O)/N)CN2[C@@H]([C@@H]([C@H](N(C2=O)Cc3cccc(c3)/C(=N\O)/N)Cc4ccc(cc4)F)O)CCc5ccc(cc5)F