
 CID 10415322

 79 84  0  0  0  0  0  0  0  0999 V2000
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M  END

>  <Chemical Name>
CID 10415322

>  <PubChem CID>
10415322

>  <Formula>
C29H40N4O5S

>  <Molecular Weight>
556.722000

>  <IUPAC Name>
3-[1-[(1R,3S,4S)-7,7-dimethyl-4-(spiro[1,2-dihydroindene-3,4'-piperidine]-1'-ylsulfonylmethyl)-3-bicyclo[2.2.1]heptanyl]-2,5-dioxoimidazolidin-4-yl]propanamide

>  <XlogP>
2.900

>  <Hydrogen Bond Donors>
2

>  <Hydrogen Bond Acceptors>
6

>  <Canonical SMILES>
CC1(C2CCC1(C(C2)N3C(=O)C(NC3=O)CCC(=O)N)CS(=O)(=O)N4CCC5(CCC6=CC=CC=C65)CC4)C

>  <Isomeric SMILES>
CC1([C@@H]2CC[C@]1([C@H](C2)N3C(=O)C(NC3=O)CCC(=O)N)CS(=O)(=O)N4CCC5(CCC6=CC=CC=C65)CC4)C

>  <InChI Std. ID>
InChI=1S/C29H40N4O5S/c1-27(2)20-10-12-29(27,23(17-20)33-25(35)22(31-26(33)36)7-8-24(30)34)18-39(37,38)32-15-13-28(14-16-32)11-9-19-5-3-4-6-21(19)28/h3-6,20,22-23H,7-18H2,1-2H3,(H2,30,34)(H,31,36)/t20-,22?,23+,29-/m1/s1

>  <InChI Key>
CIAAPGAYGUUMOS-CEBNGQAMSA-N

