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JCZ

Summary
Name:3-(1~{H}-indol-6-yl)-1~{H}-pyrazol-5-amine
Formula:C11 H10 N4
Formal charge:0
Formula weight:198.224 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.73-(1~{H}-indol-6-yl)-1~{H}-pyrazol-5-amine

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C11H10N4/c12-11-6-10(14-15-11)8-2-1-7-3-4-13-9(7)5-8/h1-6,13H,(H3,12,14,15)
InChIKeyInChI1.03WGNBSWSUVHVDSW-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385Nc1[nH]nc(c1)c2ccc3cc[nH]c3c2
SMILESCACTVS3.385Nc1[nH]nc(c1)c2ccc3cc[nH]c3c2
SMILES_CANONICALOpenEye OEToolkits2.0.7c1cc(cc2c1cc[nH]2)c3cc([nH]n3)N
SMILESOpenEye OEToolkits2.0.7c1cc(cc2c1cc[nH]2)c3cc([nH]n3)N

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數據於2024-07-17公開中

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