
 MLS000552282

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M  END

>  <Chemical Name>
MLS000552282

>  <PubChem CID>
1130106

>  <Formula>
C22H17N3OS2

>  <Molecular Weight>
403.518000

>  <IUPAC Name>
2-(1-methylbenzimidazol-2-yl)sulfanyl-1-phenothiazin-10-ylethanone

>  <XlogP>
5.1

>  <Hydrogen Bond Donors>
0

>  <Hydrogen Bond Acceptors>
4

>  <Canonical SMILES>
CN1C2=CC=CC=C2N=C1SCC(=O)N3C4=CC=CC=C4SC5=CC=CC=C53

>  <Isomeric SMILES>
CN1C2=CC=CC=C2N=C1SCC(=O)N3C4=CC=CC=C4SC5=CC=CC=C53

>  <InChI Std. ID>
InChI=1S/C22H17N3OS2/c1-24-16-9-3-2-8-15(16)23-22(24)27-14-21(26)25-17-10-4-6-12-19(17)28-20-13-7-5-11-18(20)25/h2-13H,14H2,1H3

>  <InChI Key>
BEHRZOZMQWWDAA-UHFFFAOYSA-N

