2-(3,5-dimethyl-1-adamantyl)-N-[2-[(1-ethylpyrrolidin-2-yl)methyl]-1-oxidanylidene-isoquinolin-5-yl]ethanamide

Systemtic Name: 2-(3,5-dimethyl-1-adamantyl)-N-[2-[(1-ethylpyrrolidin-2-yl)methyl]-1-oxidanylidene-isoquinolin-5-yl]ethanamide Openeye Name: 2-(3,5-dimethyl-1-adamantyl)-N-[2-[(1-ethylpyrrolidin-2-yl)methyl]-1-oxo-5-isoquinolyl]acetamide CAS Name: 2-(3,5-dimethyl-1-adamantyl)-N-[2-[(1-ethyl-2-pyrrolidinyl)methyl]-1-oxo-5-isoquinolinyl]acetamide IUPAC Name: 2-(3,5-dimethyl-1-adamantyl)-N-[2-[(1-ethylpyrrolidin-2-yl)methyl]-1-oxoisoquinolin-5-yl]acetamide Traditional Name: 2-(3,5-dimethyl-1-adamantyl)-N-[2-[(1-ethylpyrrolidin-2-yl)methyl]-1-keto-5-isoquinolyl]acetamide Formula: C30H41N3O2 MolecularWeight: 475.66544

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCCC1CN2C=CC3=C(C2=O)C=CC=C3NC(=O)CC45CC6CC(C4)(CC(C6)(C5)C)C

Isomeric SMILES

CCN1CCCC1CN2C=CC3=C(C2=O)C=CC=C3NC(=O)CC45CC6CC(C4)(CC(C6)(C5)C)C

InChI

InChI=1S/C30H41N3O2/c1-4-32-11-6-7-22(32)17-33-12-10-23-24(27(33)35)8-5-9-25(23)31-26(34)16-30-15-21-13-28(2,19-30)18-29(3,14-21)20-30/h5,8-10,12,21-22H,4,6-7,11,13-20H2,1-3H3,(H,31,34)