N-[1-[1-(2-bromanylprop-2-enyl)benzimidazol-2-yl]ethyl]-2,4-dimethyl-benzamide

Systemtic Name: N-[1-[1-(2-bromanylprop-2-enyl)benzimidazol-2-yl]ethyl]-2,4-dimethyl-benzamide Openeye Name: N-[1-[1-(2-bromoallyl)benzimidazol-2-yl]ethyl]-2,4-dimethyl-benzamide CAS Name: N-[1-[1-(2-bromoprop-2-enyl)-2-benzimidazolyl]ethyl]-2,4-dimethylbenzamide IUPAC Name: N-[1-[1-(2-bromoprop-2-enyl)benzimidazol-2-yl]ethyl]-2,4-dimethylbenzamide Traditional Name: N-[1-[1-(2-bromoallyl)benzimidazol-2-yl]ethyl]-2,4-dimethyl-benzamide Formula: C21H22BrN3O MolecularWeight: 412.32288

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)NC(C)C2=NC3=CC=CC=C3N2CC(=C)Br)C

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)NC(C)C2=NC3=CC=CC=C3N2CC(=C)Br)C

InChI

InChI=1S/C21H22BrN3O/c1-13-9-10-17(14(2)11-13)21(26)23-16(4)20-24-18-7-5-6-8-19(18)25(20)12-15(3)22/h5-11,16H,3,12H2,1-2,4H3,(H,23,26)