EBE

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Summary

Name:(2~{S})-2-(2-fluorophenyl)-2-[4-(2-methylpyrimidin-5-yl)phenyl]-~{N}-oxidanyl-ethanamide
Formula:C19 H16 F N3 O2
Formal charge:0
Molecular weight:337.348 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.6(2~{S})-2-(2-fluorophenyl)-2-[4-(2-methylpyrimidin-5-yl)phenyl]-~{N}-oxidanyl-ethanamide

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C19H16FN3O2/c1-12-21-10-15(11-22-12)13-6-8-14(9-7-13)18(19(24)23-25)16-4-2-3-5-17(16)20/h2-11,18,25H,1H3,(H,23,24)/t18-/m0/s1
InChIKeyInChI1.03SFXMVIQZYOMYOF-SFHVURJKSA-N
SMILES_CANONICALCACTVS3.385Cc1ncc(cn1)c2ccc(cc2)[C@H](C(=O)NO)c3ccccc3F
SMILESCACTVS3.385Cc1ncc(cn1)c2ccc(cc2)[CH](C(=O)NO)c3ccccc3F
SMILES_CANONICALOpenEye OEToolkits2.0.6Cc1ncc(cn1)c2ccc(cc2)[C@@H](c3ccccc3F)C(=O)NO
SMILESOpenEye OEToolkits2.0.6Cc1ncc(cn1)c2ccc(cc2)C(c3ccccc3F)C(=O)NO
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