
 SCHEMBL6802950

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M  END

>  <Chemical Name>
SCHEMBL6802950

>  <PubChem CID>
53636492

>  <Formula>
C25H23N5O2

>  <Molecular Weight>
425.492000

>  <IUPAC Name>
4-[(2-naphthalen-1-yl-5-oxo-1,3-oxazol-4-ylidene)methyl]-N'-phenylpiperazine-1-carboximidamide

>  <XlogP>
3.6

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
5

>  <Canonical SMILES>
C1CN(CCN1C=C2C(=O)OC(=N2)C3=CC=CC4=CC=CC=C43)C(=NC5=CC=CC=C5)N

>  <Isomeric SMILES>
C1CN(CCN1C=C2C(=O)OC(=N2)C3=CC=CC4=CC=CC=C43)C(=NC5=CC=CC=C5)N

>  <InChI Std. ID>
InChI=1S/C25H23N5O2/c26-25(27-19-9-2-1-3-10-19)30-15-13-29(14-16-30)17-22-24(31)32-23(28-22)21-12-6-8-18-7-4-5-11-20(18)21/h1-12,17H,13-16H2,(H2,26,27)

>  <InChI Key>
ADANDPMLNDAKNZ-UHFFFAOYSA-N

