N'-[(3-chloranyl-1-adamantyl)carbonyl]-1-ethyl-2-methyl-benzimidazole-5-carbohydrazide

Systemtic Name: N'-[(3-chloranyl-1-adamantyl)carbonyl]-1-ethyl-2-methyl-benzimidazole-5-carbohydrazide Openeye Name: N'-(3-chloroadamantane-1-carbonyl)-1-ethyl-2-methyl-benzimidazole-5-carbohydrazide CAS Name: N'-[(3-chloro-1-adamantyl)-oxomethyl]-1-ethyl-2-methyl-5-benzimidazolecarbohydrazide IUPAC Name: N'-(3-chloroadamantane-1-carbonyl)-1-ethyl-2-methylbenzimidazole-5-carbohydrazide Traditional Name: N'-(3-chloroadamantane-1-carbonyl)-1-ethyl-2-methyl-benzimidazole-5-carbohydrazide Formula: C22H27ClN4O2 MolecularWeight: 414.92838

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NC2=C1C=CC(=C2)C(=O)NNC(=O)C34CC5CC(C3)CC(C5)(C4)Cl)C

Isomeric SMILES

CCN1C(=NC2=C1C=CC(=C2)C(=O)NNC(=O)C34CC5CC(C3)CC(C5)(C4)Cl)C

InChI

InChI=1S/C22H27ClN4O2/c1-3-27-13(2)24-17-7-16(4-5-18(17)27)19(28)25-26-20(29)21-8-14-6-15(9-21)11-22(23,10-14)12-21/h4-5,7,14-15H,3,6,8-12H2,1-2H3,(H,25,28)(H,26,29)