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A1BQL

Summary
Name:(3S)-1-[(1-methyl-1H-indazol-3-yl)methyl]-6-oxopiperidine-3-carboxamide
Formula:C15 H18 N4 O2
Formal charge:0
Formula weight:286.329 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
ACDLabs14.52(3S)-1-[(1-methyl-1H-indazol-3-yl)methyl]-6-oxopiperidine-3-carboxamide
OpenEye OEToolkits3.1.0.0(3~{S})-1-[(1-methylindazol-3-yl)methyl]-6-oxidanylidene-piperidine-3-carboxamide

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs14.52NC(=O)C1CCC(=O)N(C1)Cc1nn(C)c2ccccc21
InChIInChI1.06InChI=1S/C15H18N4O2/c1-18-13-5-3-2-4-11(13)12(17-18)9-19-8-10(15(16)21)6-7-14(19)20/h2-5,10H,6-9H2,1H3,(H2,16,21)/t10-/m0/s1
InChIKeyInChI1.06UHXKXPHIDBJBOP-JTQLQIEISA-N
SMILES_CANONICALCACTVS3.385Cn1nc(CN2C[C@H](CCC2=O)C(N)=O)c3ccccc13
SMILESCACTVS3.385Cn1nc(CN2C[CH](CCC2=O)C(N)=O)c3ccccc13
SMILES_CANONICALOpenEye OEToolkits3.1.0.0Cn1c2ccccc2c(n1)CN3C[C@H](CCC3=O)C(=O)N
SMILESOpenEye OEToolkits3.1.0.0Cn1c2ccccc2c(n1)CN3CC(CCC3=O)C(=O)N

236620

건을2025-05-28부터공개중

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