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L0D

Summary
Name:2-(1H-pyrazol-3-yl)-1H-benzimidazole
Formula:C10 H8 N4
Formal charge:0
Formula weight:184.197 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs10.042-(1H-pyrazol-3-yl)-1H-benzimidazole
OpenEye OEToolkits1.5.02-(1H-pyrazol-3-yl)-1H-benzimidazole

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04n2c1c(cccc1)nc2c3nncc3
SMILES_CANONICALCACTVS3.341[nH]1ccc(n1)c2[nH]c3ccccc3n2
SMILESCACTVS3.341[nH]1ccc(n1)c2[nH]c3ccccc3n2
SMILES_CANONICALOpenEye OEToolkits1.5.0c1ccc2c(c1)[nH]c(n2)c3cc[nH]n3
SMILESOpenEye OEToolkits1.5.0c1ccc2c(c1)[nH]c(n2)c3cc[nH]n3
InChIInChI1.03InChI=1S/C10H8N4/c1-2-4-8-7(3-1)12-10(13-8)9-5-6-11-14-9/h1-6H,(H,11,14)(H,12,13)
InChIKeyInChI1.03IYTGPPNUOLLGBE-UHFFFAOYSA-N

223532

數據於2024-08-07公開中

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