N'-[2-(1-adamantyl)ethanoyl]-1-butyl-5-chloranyl-3-methyl-pyrazole-4-carbohydrazide

Systemtic Name: N'-[2-(1-adamantyl)ethanoyl]-1-butyl-5-chloranyl-3-methyl-pyrazole-4-carbohydrazide Openeye Name: N'-[2-(1-adamantyl)acetyl]-1-butyl-5-chloro-3-methyl-pyrazole-4-carbohydrazide CAS Name: N'-[2-(1-adamantyl)-1-oxoethyl]-1-butyl-5-chloro-3-methyl-4-pyrazolecarbohydrazide IUPAC Name: N'-[2-(1-adamantyl)acetyl]-1-butyl-5-chloro-3-methylpyrazole-4-carbohydrazide Traditional Name: N'-[2-(1-adamantyl)acetyl]-1-butyl-5-chloro-3-methyl-pyrazole-4-carbohydrazide Formula: C21H31ClN4O2 MolecularWeight: 406.94944

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=N1)C)C(=O)NNC(=O)CC23CC4CC(C2)CC(C4)C3)Cl

Isomeric SMILES

CCCCN1C(=C(C(=N1)C)C(=O)NNC(=O)CC23CC4CC(C2)CC(C4)C3)Cl

InChI

InChI=1S/C21H31ClN4O2/c1-3-4-5-26-19(22)18(13(2)25-26)20(28)24-23-17(27)12-21-9-14-6-15(10-21)8-16(7-14)11-21/h14-16H,3-12H2,1-2H3,(H,23,27)(H,24,28)