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W69

Summary
Name:6-(2-{3-[3-(dimethylamino)propyl]-5-fluorophenyl}ethyl)-4-methylpyridin-2-amine
Formula:C19 H26 F N3
Formal charge:0
Formula weight:315.428 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.016-(2-{3-[3-(dimethylamino)propyl]-5-fluorophenyl}ethyl)-4-methylpyridin-2-amine
OpenEye OEToolkits2.0.66-[2-[3-[3-(dimethylamino)propyl]-5-fluoranyl-phenyl]ethyl]-4-methyl-pyridin-2-amine

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01Fc1cc(cc(c1)CCCN(C)C)CCc2cc(cc(n2)N)C
InChIInChI1.03InChI=1S/C19H26FN3/c1-14-9-18(22-19(21)10-14)7-6-16-11-15(12-17(20)13-16)5-4-8-23(2)3/h9-13H,4-8H2,1-3H3,(H2,21,22)
InChIKeyInChI1.03QAFLXFWRGFNYKW-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385CN(C)CCCc1cc(F)cc(CCc2cc(C)cc(N)n2)c1
SMILESCACTVS3.385CN(C)CCCc1cc(F)cc(CCc2cc(C)cc(N)n2)c1
SMILES_CANONICALOpenEye OEToolkits2.0.6Cc1cc(nc(c1)N)CCc2cc(cc(c2)F)CCCN(C)C
SMILESOpenEye OEToolkits2.0.6Cc1cc(nc(c1)N)CCc2cc(cc(c2)F)CCCN(C)C

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건을2024-07-17부터공개중

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