2-(1-adamantyl)-N-[2-(1-oxidanylbutan-2-ylamino)quinolin-5-yl]ethanamide

Systemtic Name: 2-(1-adamantyl)-N-[2-(1-oxidanylbutan-2-ylamino)quinolin-5-yl]ethanamide Openeye Name: 2-(1-adamantyl)-N-[2-[1-(hydroxymethyl)propylamino]-5-quinolyl]acetamide CAS Name: 2-(1-adamantyl)-N-[2-(1-hydroxybutan-2-ylamino)-5-quinolinyl]acetamide IUPAC Name: 2-(1-adamantyl)-N-[2-(1-hydroxybutan-2-ylamino)quinolin-5-yl]acetamide Traditional Name: 2-(1-adamantyl)-N-[2-(1-methylolpropylamino)-5-quinolyl]acetamide Formula: C25H33N3O2 MolecularWeight: 407.54842

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)NC1=NC2=C(C=C1)C(=CC=C2)NC(=O)CC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CCC(CO)NC1=NC2=C(C=C1)C(=CC=C2)NC(=O)CC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C25H33N3O2/c1-2-19(15-29)26-23-7-6-20-21(27-23)4-3-5-22(20)28-24(30)14-25-11-16-8-17(12-25)10-18(9-16)13-25/h3-7,16-19,29H,2,8-15H2,1H3,(H,26,27)(H,28,30)