N'-[4-(3-bromanylphenoxy)butanoyl]-1-ethyl-2-methyl-benzimidazole-5-carbohydrazide

Systemtic Name: N'-[4-(3-bromanylphenoxy)butanoyl]-1-ethyl-2-methyl-benzimidazole-5-carbohydrazide Openeye Name: N'-[4-(3-bromophenoxy)butanoyl]-1-ethyl-2-methyl-benzimidazole-5-carbohydrazide CAS Name: N'-[4-(3-bromophenoxy)-1-oxobutyl]-1-ethyl-2-methyl-5-benzimidazolecarbohydrazide IUPAC Name: N'-[4-(3-bromophenoxy)butanoyl]-1-ethyl-2-methylbenzimidazole-5-carbohydrazide Traditional Name: N'-[4-(3-bromophenoxy)butanoyl]-1-ethyl-2-methyl-benzimidazole-5-carbohydrazide Formula: C21H23BrN4O3 MolecularWeight: 459.33632

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NC2=C1C=CC(=C2)C(=O)NNC(=O)CCCOC3=CC(=CC=C3)Br)C

Isomeric SMILES

CCN1C(=NC2=C1C=CC(=C2)C(=O)NNC(=O)CCCOC3=CC(=CC=C3)Br)C

InChI

InChI=1S/C21H23BrN4O3/c1-3-26-14(2)23-18-12-15(9-10-19(18)26)21(28)25-24-20(27)8-5-11-29-17-7-4-6-16(22)13-17/h4,6-7,9-10,12-13H,3,5,8,11H2,1-2H3,(H,24,27)(H,25,28)