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6UH

Summary
Name:1-(5-methyl-3-phenyl-1,2-oxazol-4-yl)-3-[[2-(trifluoromethyl)phenyl]methyl]urea
Formula:C19 H16 F3 N3 O2
Formal charge:0
Formula weight:375.344 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.51-(5-methyl-3-phenyl-1,2-oxazol-4-yl)-3-[[2-(trifluoromethyl)phenyl]methyl]urea

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C19H16F3N3O2/c1-12-16(17(25-27-12)13-7-3-2-4-8-13)24-18(26)23-11-14-9-5-6-10-15(14)19(20,21)22/h2-10H,11H2,1H3,(H2,23,24,26)
InChIKeyInChI1.03JOPADRLBMVFGBD-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385Cc1onc(c1NC(=O)NCc2ccccc2C(F)(F)F)c3ccccc3
SMILESCACTVS3.385Cc1onc(c1NC(=O)NCc2ccccc2C(F)(F)F)c3ccccc3
SMILES_CANONICALOpenEye OEToolkits2.0.5Cc1c(c(no1)c2ccccc2)NC(=O)NCc3ccccc3C(F)(F)F
SMILESOpenEye OEToolkits2.0.5Cc1c(c(no1)c2ccccc2)NC(=O)NCc3ccccc3C(F)(F)F

223166

数据于2024-07-31公开中

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