
 SCHEMBL17938360

 64 68  0  0  0  0  0  0  0  0999 V2000
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M  END

>  <Chemical Name>
SCHEMBL17938360

>  <PubChem CID>
76283692

>  <Formula>
C27H28N4O4S

>  <Molecular Weight>
504.605000

>  <IUPAC Name>
2-(9-ethylcarbazol-3-yl)-1-(2-methoxyethyl)-N-methyl-N-methylsulfonylbenzimidazole-5-carboxamide

>  <XlogP>
3.6

>  <Hydrogen Bond Donors>
0

>  <Hydrogen Bond Acceptors>
5

>  <Canonical SMILES>
CCN1C2=C(C=C(C=C2)C3=NC4=C(N3CCOC)C=CC(=C4)C(=O)N(C)S(=O)(=O)C)C5=CC=CC=C51

>  <Isomeric SMILES>
CCN1C2=C(C=C(C=C2)C3=NC4=C(N3CCOC)C=CC(=C4)C(=O)N(C)S(=O)(=O)C)C5=CC=CC=C51

>  <InChI Std. ID>
InChI=1S/C27H28N4O4S/c1-5-30-23-9-7-6-8-20(23)21-16-18(10-12-24(21)30)26-28-22-17-19(27(32)29(2)36(4,33)34)11-13-25(22)31(26)14-15-35-3/h6-13,16-17H,5,14-15H2,1-4H3

>  <InChI Key>
ABXWYZRPBQPAAG-UHFFFAOYSA-N

