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P3J

Summary
Name:3-(PYRIDIN-3-YL)-1H-PYRAZOL-5-AMINE
Formula:C8 H8 N4
Formal charge:0
Formula weight:160.176 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
ACDLabs12.013-(pyridin-3-yl)-1H-pyrazol-5-amine
OpenEye OEToolkits1.9.23-pyridin-3-yl-1H-pyrazol-5-amine

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01n1cccc(c1)c2nnc(c2)N
InChIInChI1.03InChI=1S/C8H8N4/c9-8-4-7(11-12-8)6-2-1-3-10-5-6/h1-5H,(H3,9,11,12)
InChIKeyInChI1.03USKHSGIEOVXVFW-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385Nc1[nH]nc(c1)c2cccnc2
SMILESCACTVS3.385Nc1[nH]nc(c1)c2cccnc2
SMILES_CANONICALOpenEye OEToolkits1.9.2c1cc(cnc1)c2cc([nH]n2)N
SMILESOpenEye OEToolkits1.9.2c1cc(cnc1)c2cc([nH]n2)N

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数据于2024-07-17公开中

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