3-methyl-4-oxidanylidene-4-[2-[4-(2-oxidanylidene-1,4-dihydroquinazolin-3-yl)piperidin-1-yl]-4-piperidin-1-yl-2-[2-(trifluoromethyl)phenyl]piperidin-1-yl]butanal

Systemtic Name: 3-methyl-4-oxidanylidene-4-[2-[4-(2-oxidanylidene-1,4-dihydroquinazolin-3-yl)piperidin-1-yl]-4-piperidin-1-yl-2-[2-(trifluoromethyl)phenyl]piperidin-1-yl]butanal Openeye Name: 3-methyl-4-oxo-4-[2-[4-(2-oxo-1,4-dihydroquinazolin-3-yl)-1-piperidyl]-4-(1-piperidyl)-2-[2-(trifluoromethyl)phenyl]-1-piperidyl]butanal CAS Name: 3-methyl-4-oxo-4-[2-[4-(2-oxo-1,4-dihydroquinazolin-3-yl)-1-piperidinyl]-4-(1-piperidinyl)-2-[2-(trifluoromethyl)phenyl]-1-piperidinyl]butanal IUPAC Name: 3-methyl-4-oxo-4-[2-[4-(2-oxo-1,4-dihydroquinazolin-3-yl)piperidin-1-yl]-4-piperidin-1-yl-2-[2-(trifluoromethyl)phenyl]piperidin-1-yl]butanal Traditional Name: 4-keto-4-[2-[4-(2-keto-1,4-dihydroquinazolin-3-yl)piperidino]-4-piperidino-2-[2-(trifluoromethyl)phenyl]piperidino]-3-methyl-butyraldehyde Formula: C35H44F3N5O3 MolecularWeight: 639.75077

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC=O)C(=O)N1CCC(CC1(C2=CC=CC=C2C(F)(F)F)N3CCC(CC3)N4CC5=CC=CC=C5NC4=O)N6CCCCC6

Isomeric SMILES

CC(CC=O)C(=O)N1CCC(CC1(C2=CC=CC=C2C(F)(F)F)N3CCC(CC3)N4CC5=CC=CC=C5NC4=O)N6CCCCC6

InChI

InChI=1S/C35H44F3N5O3/c1-25(16-22-44)32(45)43-21-15-28(40-17-7-2-8-18-40)23-34(43,29-10-4-5-11-30(29)35(36,37)38)41-19-13-27(14-20-41)42-24-26-9-3-6-12-31(26)39-33(42)46/h3-6,9-12,22,25,27-28H,2,7-8,13-21,23-24H2,1H3,(H,39,46)