
 MLS000554145

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M  END

>  <Chemical Name>
MLS000554145

>  <PubChem CID>
912993

>  <Formula>
C19H21N3OS

>  <Molecular Weight>
339.457000

>  <IUPAC Name>
1-benzyl-1-(5,5-dimethyl-4H-1,3-thiazol-2-yl)-3-phenylurea

>  <XlogP>
3.6

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
3

>  <Canonical SMILES>
CC1(CN=C(S1)N(CC2=CC=CC=C2)C(=O)NC3=CC=CC=C3)C

>  <Isomeric SMILES>
CC1(CN=C(S1)N(CC2=CC=CC=C2)C(=O)NC3=CC=CC=C3)C

>  <InChI Std. ID>
InChI=1S/C19H21N3OS/c1-19(2)14-20-18(24-19)22(13-15-9-5-3-6-10-15)17(23)21-16-11-7-4-8-12-16/h3-12H,13-14H2,1-2H3,(H,21,23)

>  <InChI Key>
CFYVRWGQGFBSSD-UHFFFAOYSA-N

