
 CID 10051081

 69 74  0  0  0  0  0  0  0  0999 V2000
    2.4918    1.1300   -4.7546 C   0  0  0  0  0
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    3.3115    4.5181   -1.7050 H   0  0  0  0  0
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    5.5537    3.7741    1.9016 H   0  0  0  0  0
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    0.7235   -0.2795    6.5898 H   0  0  0  0  0
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    0.4550   -3.0779    6.9369 H   0  0  0  0  0
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    4.5506    0.2205   -3.2857 H   0  0  0  0  0
    5.5562    1.6801   -3.2829 H   0  0  0  0  0
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M  END

>  <Chemical Name>
CID 10051081

>  <PubChem CID>
10051081

>  <Formula>
C26H35N3O4S

>  <Molecular Weight>
485.643000

>  <IUPAC Name>
3-[(1R,3S,4S)-7,7-dimethyl-4-(spiro[1,2-dihydroindene-3,4'-piperidine]-1'-ylsulfonylmethyl)-3-bicyclo[2.2.1]heptanyl]imidazolidine-2,4-dione

>  <XlogP>
3.700

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
5

>  <Canonical SMILES>
CC1(C2CCC1(C(C2)N3C(=O)CNC3=O)CS(=O)(=O)N4CCC5(CCC6=CC=CC=C65)CC4)C

>  <Isomeric SMILES>
CC1([C@@H]2CC[C@]1([C@H](C2)N3C(=O)CNC3=O)CS(=O)(=O)N4CCC5(CCC6=CC=CC=C65)CC4)C

>  <InChI Std. ID>
InChI=1S/C26H35N3O4S/c1-24(2)19-8-10-26(24,21(15-19)29-22(30)16-27-23(29)31)17-34(32,33)28-13-11-25(12-14-28)9-7-18-5-3-4-6-20(18)25/h3-6,19,21H,7-17H2,1-2H3,(H,27,31)/t19-,21+,26-/m1/s1

>  <InChI Key>
CYAAOSBKNSIHNT-BNIKKZEQSA-N

