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Summary
Name:Nalpha-[5-chloro-6-methyl-2-(pyridin-2-yl)pyrimidin-4-yl]-D-phenylalaninamide
Formula:C19 H18 Cl N5 O
Formal charge:0
Formula weight:367.832 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.01Nalpha-[5-chloro-6-methyl-2-(pyridin-2-yl)pyrimidin-4-yl]-D-phenylalaninamide
OpenEye OEToolkits1.7.6(2R)-2-[(5-chloranyl-6-methyl-2-pyridin-2-yl-pyrimidin-4-yl)amino]-3-phenyl-propanamide

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01O=C(N)C(Nc1nc(nc(c1Cl)C)c2ncccc2)Cc3ccccc3
InChIInChI1.03InChI=1S/C19H18ClN5O/c1-12-16(20)19(25-18(23-12)14-9-5-6-10-22-14)24-15(17(21)26)11-13-7-3-2-4-8-13/h2-10,15H,11H2,1H3,(H2,21,26)(H,23,24,25)/t15-/m1/s1
InChIKeyInChI1.03SELSGPMCFPHSDG-OAHLLOKOSA-N
SMILES_CANONICALCACTVS3.370Cc1nc(nc(N[C@H](Cc2ccccc2)C(N)=O)c1Cl)c3ccccn3
SMILESCACTVS3.370Cc1nc(nc(N[CH](Cc2ccccc2)C(N)=O)c1Cl)c3ccccn3
SMILES_CANONICALOpenEye OEToolkits1.7.6Cc1c(c(nc(n1)c2ccccn2)N[C@H](Cc3ccccc3)C(=O)N)Cl
SMILESOpenEye OEToolkits1.7.6Cc1c(c(nc(n1)c2ccccn2)NC(Cc3ccccc3)C(=O)N)Cl

222415

건을2024-07-10부터공개중

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