2-(1-adamantyl)-N-[2-[4-(2-hydroxyethyl)piperazin-1-yl]-6-methyl-quinolin-5-yl]ethanamide

Systemtic Name: 2-(1-adamantyl)-N-[2-[4-(2-hydroxyethyl)piperazin-1-yl]-6-methyl-quinolin-5-yl]ethanamide Openeye Name: 2-(1-adamantyl)-N-[2-[4-(2-hydroxyethyl)piperazin-1-yl]-6-methyl-5-quinolyl]acetamide CAS Name: 2-(1-adamantyl)-N-[2-[4-(2-hydroxyethyl)-1-piperazinyl]-6-methyl-5-quinolinyl]acetamide IUPAC Name: 2-(1-adamantyl)-N-[2-[4-(2-hydroxyethyl)piperazin-1-yl]-6-methylquinolin-5-yl]acetamide Traditional Name: 2-(1-adamantyl)-N-[2-[4-(2-hydroxyethyl)piperazino]-6-methyl-5-quinolyl]acetamide Formula: C28H38N4O2 MolecularWeight: 462.62692

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)N=C(C=C2)N3CCN(CC3)CCO)NC(=O)CC45CC6CC(C4)CC(C6)C5

Isomeric SMILES

CC1=C(C2=C(C=C1)N=C(C=C2)N3CCN(CC3)CCO)NC(=O)CC45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C28H38N4O2/c1-19-2-4-24-23(3-5-25(29-24)32-8-6-31(7-9-32)10-11-33)27(19)30-26(34)18-28-15-20-12-21(16-28)14-22(13-20)17-28/h2-5,20-22,33H,6-18H2,1H3,(H,30,34)