2-(1-adamantyl)-N-[6-methyl-2-[3-(methylamino)propylamino]quinolin-5-yl]ethanamide

Systemtic Name: 2-(1-adamantyl)-N-[6-methyl-2-[3-(methylamino)propylamino]quinolin-5-yl]ethanamide Openeye Name: 2-(1-adamantyl)-N-[6-methyl-2-[3-(methylamino)propylamino]-5-quinolyl]acetamide CAS Name: 2-(1-adamantyl)-N-[6-methyl-2-[3-(methylamino)propylamino]-5-quinolinyl]acetamide IUPAC Name: 2-(1-adamantyl)-N-[6-methyl-2-[3-(methylamino)propylamino]quinolin-5-yl]acetamide Traditional Name: 2-(1-adamantyl)-N-[6-methyl-2-[3-(methylamino)propylamino]-5-quinolyl]acetamide Formula: C26H36N4O MolecularWeight: 420.59024

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)N=C(C=C2)NCCCNC)NC(=O)CC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC1=C(C2=C(C=C1)N=C(C=C2)NCCCNC)NC(=O)CC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C26H36N4O/c1-17-4-6-22-21(5-7-23(29-22)28-9-3-8-27-2)25(17)30-24(31)16-26-13-18-10-19(14-26)12-20(11-18)15-26/h4-7,18-20,27H,3,8-16H2,1-2H3,(H,28,29)(H,30,31)