2-(1-adamantyl)-N-[2-[1-(5-methylpyrazin-2-yl)ethyl]-1-oxidanylidene-3,4-dihydroisoquinolin-5-yl]ethanamide

Systemtic Name: 2-(1-adamantyl)-N-[2-[1-(5-methylpyrazin-2-yl)ethyl]-1-oxidanylidene-3,4-dihydroisoquinolin-5-yl]ethanamide Openeye Name: 2-(1-adamantyl)-N-[2-[1-(5-methylpyrazin-2-yl)ethyl]-1-oxo-3,4-dihydroisoquinolin-5-yl]acetamide CAS Name: 2-(1-adamantyl)-N-[2-[1-(5-methyl-2-pyrazinyl)ethyl]-1-oxo-3,4-dihydroisoquinolin-5-yl]acetamide IUPAC Name: 2-(1-adamantyl)-N-[2-[1-(5-methylpyrazin-2-yl)ethyl]-1-oxo-3,4-dihydroisoquinolin-5-yl]acetamide Traditional Name: 2-(1-adamantyl)-N-[1-keto-2-[1-(5-methylpyrazin-2-yl)ethyl]-3,4-dihydroisoquinolin-5-yl]acetamide Formula: C28H34N4O2 MolecularWeight: 458.59516

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C=N1)C(C)N2CCC3=C(C2=O)C=CC=C3NC(=O)CC45CC6CC(C4)CC(C6)C5

Isomeric SMILES

CC1=CN=C(C=N1)C(C)N2CCC3=C(C2=O)C=CC=C3NC(=O)CC45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C28H34N4O2/c1-17-15-30-25(16-29-17)18(2)32-7-6-22-23(27(32)34)4-3-5-24(22)31-26(33)14-28-11-19-8-20(12-28)10-21(9-19)13-28/h3-5,15-16,18-21H,6-14H2,1-2H3,(H,31,33)