
 CHEMBL64493

 51 55  0  0  0  0  0  0  0  0999 V2000
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M  END

>  <Chemical Name>
CHEMBL64493

>  <PubChem CID>
10476962

>  <Formula>
C24H21N3O2S

>  <Molecular Weight>
415.511000

>  <IUPAC Name>
(7-phenylmethoxyindol-1-yl)-[(4R)-2-pyridin-3-yl-1,3-thiazolidin-4-yl]methanone

>  <XlogP>
4.0

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
5

>  <Canonical SMILES>
C1C(NC(S1)C2=CN=CC=C2)C(=O)N3C=CC4=C3C(=CC=C4)OCC5=CC=CC=C5

>  <Isomeric SMILES>
C1[C@H](NC(S1)C2=CN=CC=C2)C(=O)N3C=CC4=C3C(=CC=C4)OCC5=CC=CC=C5

>  <InChI Std. ID>
InChI=1S/C24H21N3O2S/c28-24(20-16-30-23(26-20)19-9-5-12-25-14-19)27-13-11-18-8-4-10-21(22(18)27)29-15-17-6-2-1-3-7-17/h1-14,20,23,26H,15-16H2/t20-,23?/m0/s1

>  <InChI Key>
BJENIYJBEWYWPI-AJZOCDQUSA-N

