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A1BQ9

Summary
Name:N-[2,2-difluoro-2-(pyridin-2-yl)ethyl]-1-methyl-1H-indazole-3-carboxamide
Formula:C16 H14 F2 N4 O
Formal charge:0
Formula weight:316.305 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
ACDLabs14.52N-[2,2-difluoro-2-(pyridin-2-yl)ethyl]-1-methyl-1H-indazole-3-carboxamide
OpenEye OEToolkits3.1.0.0~{N}-[2,2-bis(fluoranyl)-2-pyridin-2-yl-ethyl]-1-methyl-indazole-3-carboxamide

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs14.52FC(F)(CNC(=O)c1nn(C)c2ccccc21)c1ccccn1
InChIInChI1.06InChI=1S/C16H14F2N4O/c1-22-12-7-3-2-6-11(12)14(21-22)15(23)20-10-16(17,18)13-8-4-5-9-19-13/h2-9H,10H2,1H3,(H,20,23)
InChIKeyInChI1.06CKEMLAIIJWKKOM-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385Cn1nc(C(=O)NCC(F)(F)c2ccccn2)c3ccccc13
SMILESCACTVS3.385Cn1nc(C(=O)NCC(F)(F)c2ccccn2)c3ccccc13
SMILES_CANONICALOpenEye OEToolkits3.1.0.0Cn1c2ccccc2c(n1)C(=O)NCC(c3ccccn3)(F)F
SMILESOpenEye OEToolkits3.1.0.0Cn1c2ccccc2c(n1)C(=O)NCC(c3ccccn3)(F)F

248636

PDB entries from 2026-02-04

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