N-[(1R)-1-(1-adamantyl)ethyl]-2-(5-methylfuran-2-yl)quinoline-4-carboxamide

Systemtic Name: N-[(1R)-1-(1-adamantyl)ethyl]-2-(5-methylfuran-2-yl)quinoline-4-carboxamide Openeye Name: N-[(1R)-1-(1-adamantyl)ethyl]-2-(5-methyl-2-furyl)quinoline-4-carboxamide CAS Name: N-[(1R)-1-(1-adamantyl)ethyl]-2-(5-methyl-2-furanyl)-4-quinolinecarboxamide IUPAC Name: N-[(1R)-1-(1-adamantyl)ethyl]-2-(5-methylfuran-2-yl)quinoline-4-carboxamide Traditional Name: N-[(1R)-1-(1-adamantyl)ethyl]-2-(5-methyl-2-furyl)cinchoninamide Formula: C27H30N2O2 MolecularWeight: 414.5393

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC(C)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

CC1=CC=C(O1)C2=NC3=CC=CC=C3C(=C2)C(=O)N[C@H](C)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C27H30N2O2/c1-16-7-8-25(31-16)24-12-22(21-5-3-4-6-23(21)29-24)26(30)28-17(2)27-13-18-9-19(14-27)11-20(10-18)15-27/h3-8,12,17-20H,9-11,13-15H2,1-2H3,(H,28,30)/t17-,18?,19?,20?,27?/m1/s1