2-(1-adamantyl)-N-[2-[2-(furan-3-ylmethylamino)ethylamino]quinolin-5-yl]ethanamide

Systemtic Name: 2-(1-adamantyl)-N-[2-[2-(furan-3-ylmethylamino)ethylamino]quinolin-5-yl]ethanamide Openeye Name: 2-(1-adamantyl)-N-[2-[2-(3-furylmethylamino)ethylamino]-5-quinolyl]acetamide CAS Name: 2-(1-adamantyl)-N-[2-[2-(3-furanylmethylamino)ethylamino]-5-quinolinyl]acetamide IUPAC Name: 2-(1-adamantyl)-N-[2-[2-(furan-3-ylmethylamino)ethylamino]quinolin-5-yl]acetamide Traditional Name: 2-(1-adamantyl)-N-[2-[2-(3-furfurylamino)ethylamino]-5-quinolyl]acetamide Formula: C28H34N4O2 MolecularWeight: 458.59516

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CC(=O)NC4=CC=CC5=C4C=CC(=N5)NCCNCC6=COC=C6

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)CC(=O)NC4=CC=CC5=C4C=CC(=N5)NCCNCC6=COC=C6

InChI

InChI=1S/C28H34N4O2/c33-27(16-28-13-20-10-21(14-28)12-22(11-20)15-28)32-25-3-1-2-24-23(25)4-5-26(31-24)30-8-7-29-17-19-6-9-34-18-19/h1-6,9,18,20-22,29H,7-8,10-17H2,(H,30,31)(H,32,33)