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Z30

Summary
Name:(5R)-5-tert-butyl-4,5,6,7-tetrahydro-1H-indazole-3-carbohydrazide
Formula:C12 H20 N4 O
Formal charge:0
Formula weight:236.313 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.01(5R)-5-tert-butyl-4,5,6,7-tetrahydro-1H-indazole-3-carbohydrazide
OpenEye OEToolkits1.7.0(5R)-5-tert-butyl-4,5,6,7-tetrahydro-1H-indazole-3-carbohydrazide

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01O=C(c1nnc2c1CC(CC2)C(C)(C)C)NN
SMILES_CANONICALCACTVS3.370CC(C)(C)[C@@H]1CCc2[nH]nc(C(=O)NN)c2C1
SMILESCACTVS3.370CC(C)(C)[CH]1CCc2[nH]nc(C(=O)NN)c2C1
SMILES_CANONICALOpenEye OEToolkits1.7.0CC(C)(C)[C@@H]1CCc2c(c(n[nH]2)C(=O)NN)C1
SMILESOpenEye OEToolkits1.7.0CC(C)(C)C1CCc2c(c(n[nH]2)C(=O)NN)C1
InChIInChI1.03InChI=1S/C12H20N4O/c1-12(2,3)7-4-5-9-8(6-7)10(16-15-9)11(17)14-13/h7H,4-6,13H2,1-3H3,(H,14,17)(H,15,16)/t7-/m1/s1
InChIKeyInChI1.03WPAHESSOUBKEIY-SSDOTTSWSA-N

222415

PDB entries from 2024-07-10

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