D6X

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Summary

Name:N-[2-(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)ethyl]quinolin-2-amine
Formula:C18 H18 N6
Formal charge:0
Molecular weight:318.376 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.7~{N}-[2-(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)ethyl]quinolin-2-amine

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C18H18N6/c1-12-11-13(2)24-18(20-12)22-17(23-24)9-10-19-16-8-7-14-5-3-4-6-15(14)21-16/h3-8,11H,9-10H2,1-2H3,(H,19,21)
InChIKeyInChI1.03GAAIMHFFJZPUGG-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385Cc1cc(C)n2nc(CCNc3ccc4ccccc4n3)nc2n1
SMILESCACTVS3.385Cc1cc(C)n2nc(CCNc3ccc4ccccc4n3)nc2n1
SMILES_CANONICALOpenEye OEToolkits2.0.7Cc1cc(n2c(n1)nc(n2)CCNc3ccc4ccccc4n3)C
SMILESOpenEye OEToolkits2.0.7Cc1cc(n2c(n1)nc(n2)CCNc3ccc4ccccc4n3)C