N'-(1-adamantylcarbonyl)-3-(2-chlorophenyl)-1H-pyrazole-5-carbohydrazide

Systemtic Name: N'-(1-adamantylcarbonyl)-3-(2-chlorophenyl)-1H-pyrazole-5-carbohydrazide Openeye Name: N'-(adamantane-1-carbonyl)-3-(2-chlorophenyl)-1H-pyrazole-5-carbohydrazide CAS Name: N'-[1-adamantyl(oxo)methyl]-3-(2-chlorophenyl)-1H-pyrazole-5-carbohydrazide IUPAC Name: N'-(adamantane-1-carbonyl)-3-(2-chlorophenyl)-1H-pyrazole-5-carbohydrazide Traditional Name: N'-(adamantane-1-carbonyl)-3-(2-chlorophenyl)-1H-pyrazole-5-carbohydrazide Formula: C21H23ClN4O2 MolecularWeight: 398.88592

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)NNC(=O)C4=CC(=NN4)C5=CC=CC=C5Cl

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)NNC(=O)C4=CC(=NN4)C5=CC=CC=C5Cl

InChI

InChI=1S/C21H23ClN4O2/c22-16-4-2-1-3-15(16)17-8-18(24-23-17)19(27)25-26-20(28)21-9-12-5-13(10-21)7-14(6-12)11-21/h1-4,8,12-14H,5-7,9-11H2,(H,23,24)(H,25,27)(H,26,28)