2-(3,5-dimethyl-1-adamantyl)-N-[2-(imidazo[1,2-a]pyridin-2-ylmethyl)-1-oxidanylidene-isoquinolin-5-yl]ethanamide

Systemtic Name: 2-(3,5-dimethyl-1-adamantyl)-N-[2-(imidazo[1,2-a]pyridin-2-ylmethyl)-1-oxidanylidene-isoquinolin-5-yl]ethanamide Openeye Name: 2-(3,5-dimethyl-1-adamantyl)-N-[2-(imidazo[1,2-a]pyridin-2-ylmethyl)-1-oxo-5-isoquinolyl]acetamide CAS Name: 2-(3,5-dimethyl-1-adamantyl)-N-[2-(2-imidazo[1,2-a]pyridinylmethyl)-1-oxo-5-isoquinolinyl]acetamide IUPAC Name: 2-(3,5-dimethyl-1-adamantyl)-N-[2-(imidazo[1,2-a]pyridin-2-ylmethyl)-1-oxoisoquinolin-5-yl]acetamide Traditional Name: 2-(3,5-dimethyl-1-adamantyl)-N-[2-(imidazo[1,2-a]pyridin-2-ylmethyl)-1-keto-5-isoquinolyl]acetamide Formula: C31H34N4O2 MolecularWeight: 494.62726

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Descriptors Computed from Structure

Canonical SMILES:

CC12CC3CC(C1)(CC(C3)(C2)CC(=O)NC4=CC=CC5=C4C=CN(C5=O)CC6=CN7C=CC=CC7=N6)C

Isomeric SMILES

CC12CC3CC(C1)(CC(C3)(C2)CC(=O)NC4=CC=CC5=C4C=CN(C5=O)CC6=CN7C=CC=CC7=N6)C

InChI

InChI=1S/C31H34N4O2/c1-29-12-21-13-30(2,18-29)20-31(14-21,19-29)15-27(36)33-25-7-5-6-24-23(25)9-11-35(28(24)37)17-22-16-34-10-4-3-8-26(34)32-22/h3-11,16,21H,12-15,17-20H2,1-2H3,(H,33,36)