1-(1-adamantyl)-2-[2-azanylidene-3-(2-diethylaminoethyl)benzimidazol-1-yl]ethanone hydrobromide

Systemtic Name: 1-(1-adamantyl)-2-[2-azanylidene-3-(2-diethylaminoethyl)benzimidazol-1-yl]ethanone hydrobromide Openeye Name: 1-(1-adamantyl)-2-[3-(2-diethylaminoethyl)-2-imino-benzimidazol-1-yl]ethanone hydrobromide CAS Name: 1-(1-adamantyl)-2-[3-(2-diethylaminoethyl)-2-imino-1-benzimidazolyl]ethanone hydrobromide IUPAC Name: 1-(1-adamantyl)-2-[3-(2-diethylaminoethyl)-2-iminobenzimidazol-1-yl]ethanone hydrobromide Traditional Name: 1-(1-adamantyl)-2-[3-(2-diethylaminoethyl)-2-imino-benzimidazol-1-yl]ethanone hydrobromide Formula: C25H37BrN4O MolecularWeight: 489.49148

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN1C2=CC=CC=C2N(C1=N)CC(=O)C34CC5CC(C3)CC(C5)C4.Br

Isomeric SMILES

CCN(CC)CCN1C2=CC=CC=C2N(C1=N)CC(=O)C34CC5CC(C3)CC(C5)C4.Br

InChI

InChI=1S/C25H36N4O.BrH/c1-3-27(4-2)9-10-28-21-7-5-6-8-22(21)29(24(28)26)17-23(30)25-14-18-11-19(15-25)13-20(12-18)16-25;/h5-8,18-20,26H,3-4,9-17H2,1-2H3;1H