2-[3-(2-naphthalen-1-ylethyl)-2,4,8-tris(oxidanylidene)-1H-pyrido[3,4-d]pyrimidin-7-yl]-N-[1,1,1-tris(fluoranyl)-4-methyl-2-oxidanyl-pentan-3-yl]ethanamide

Systemtic Name: 2-[3-(2-naphthalen-1-ylethyl)-2,4,8-tris(oxidanylidene)-1H-pyrido[3,4-d]pyrimidin-7-yl]-N-[1,1,1-tris(fluoranyl)-4-methyl-2-oxidanyl-pentan-3-yl]ethanamide Openeye Name: 2-[3-[2-(1-naphthyl)ethyl]-2,4,8-trioxo-1H-pyrido[3,4-d]pyrimidin-7-yl]-N-(3,3,3-trifluoro-2-hydroxy-1-isopropyl-propyl)acetamide CAS Name: 2-[3-[2-(1-naphthalenyl)ethyl]-2,4,8-trioxo-1H-pyrido[3,4-d]pyrimidin-7-yl]-N-(1,1,1-trifluoro-2-hydroxy-4-methylpentan-3-yl)acetamide IUPAC Name: 2-[3-(2-naphthalen-1-ylethyl)-2,4,8-trioxo-1H-pyrido[3,4-d]pyrimidin-7-yl]-N-(1,1,1-trifluoro-2-hydroxy-4-methylpentan-3-yl)acetamide Traditional Name: N-(3,3,3-trifluoro-2-hydroxy-1-isopropyl-propyl)-2-[2,4,8-triketo-3-[2-(1-naphthyl)ethyl]-1H-pyrido[3,4-d]pyrimidin-7-yl]acetamide Formula: C27H27F3N4O5 MolecularWeight: 544.52229

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(C(F)(F)F)O)NC(=O)CN1C=CC2=C(C1=O)NC(=O)N(C2=O)CCC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CC(C)C(C(C(F)(F)F)O)NC(=O)CN1C=CC2=C(C1=O)NC(=O)N(C2=O)CCC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C27H27F3N4O5/c1-15(2)21(23(36)27(28,29)30)31-20(35)14-33-12-11-19-22(25(33)38)32-26(39)34(24(19)37)13-10-17-8-5-7-16-6-3-4-9-18(16)17/h3-9,11-12,15,21,23,36H,10,13-14H2,1-2H3,(H,31,35)(H,32,39)