2-(1-adamantyl)-N-(6-methyl-2-piperazin-1-yl-quinolin-5-yl)ethanamide hydrochloride

Systemtic Name: 2-(1-adamantyl)-N-(6-methyl-2-piperazin-1-yl-quinolin-5-yl)ethanamide hydrochloride Openeye Name: 2-(1-adamantyl)-N-(6-methyl-2-piperazin-1-yl-5-quinolyl)acetamide hydrochloride CAS Name: 2-(1-adamantyl)-N-[6-methyl-2-(1-piperazinyl)-5-quinolinyl]acetamide hydrochloride IUPAC Name: 2-(1-adamantyl)-N-(6-methyl-2-piperazin-1-ylquinolin-5-yl)acetamide hydrochloride Traditional Name: 2-(1-adamantyl)-N-(6-methyl-2-piperazino-5-quinolyl)acetamide hydrochloride Formula: C26H35ClN4O MolecularWeight: 455.0353

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)N=C(C=C2)N3CCNCC3)NC(=O)CC45CC6CC(C4)CC(C6)C5.Cl

Isomeric SMILES

CC1=C(C2=C(C=C1)N=C(C=C2)N3CCNCC3)NC(=O)CC45CC6CC(C4)CC(C6)C5.Cl

InChI

InChI=1S/C26H34N4O.ClH/c1-17-2-4-22-21(3-5-23(28-22)30-8-6-27-7-9-30)25(17)29-24(31)16-26-13-18-10-19(14-26)12-20(11-18)15-26;/h2-5,18-20,27H,6-16H2,1H3,(H,29,31);1H