1-(1-adamantyl)-2-(2-azanylidene-3,6-dimethyl-benzimidazol-1-yl)ethanone

Systemtic Name: 1-(1-adamantyl)-2-(2-azanylidene-3,6-dimethyl-benzimidazol-1-yl)ethanone Openeye Name: 1-(1-adamantyl)-2-(2-imino-3,6-dimethyl-benzimidazol-1-yl)ethanone CAS Name: 1-(1-adamantyl)-2-(2-imino-3,6-dimethyl-1-benzimidazolyl)ethanone IUPAC Name: 1-(1-adamantyl)-2-(2-imino-3,6-dimethylbenzimidazol-1-yl)ethanone Traditional Name: 1-(1-adamantyl)-2-(2-imino-3,6-dimethyl-benzimidazol-1-yl)ethanone Formula: C21H27N3O MolecularWeight: 337.45858

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=N)N2CC(=O)C34CC5CC(C3)CC(C5)C4)C

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=N)N2CC(=O)C34CC5CC(C3)CC(C5)C4)C

InChI

InChI=1S/C21H27N3O/c1-13-3-4-17-18(5-13)24(20(22)23(17)2)12-19(25)21-9-14-6-15(10-21)8-16(7-14)11-21/h3-5,14-16,22H,6-12H2,1-2H3