3-methyl-4-oxidanylidene-4-[2-[4-(2-oxidanylidene-1,4-dihydroquinazolin-3-yl)piperidin-1-yl]-4-piperidin-1-yl-2-(3-pyridin-2-ylphenyl)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-(3-pyridin-2-ylphenyl)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-[3-(2-pyridyl)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-[3-(2-pyridinyl)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-(3-pyridin-2-ylphenyl)piperidin-1-yl]butanal Traditional Name: 4-keto-4-[2-[4-(2-keto-1,4-dihydroquinazolin-3-yl)piperidino]-4-piperidino-2-[3-(2-pyridyl)phenyl]piperidino]-3-methyl-butyraldehyde Formula: C39H48N6O3 MolecularWeight: 648.83682

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC=O)C(=O)N1CCC(CC1(C2=CC=CC(=C2)C3=CC=CC=N3)N4CCC(CC4)N5CC6=CC=CC=C6NC5=O)N7CCCCC7

Isomeric SMILES

CC(CC=O)C(=O)N1CCC(CC1(C2=CC=CC(=C2)C3=CC=CC=N3)N4CCC(CC4)N5CC6=CC=CC=C6NC5=O)N7CCCCC7

InChI

InChI=1S/C39H48N6O3/c1-29(18-25-46)37(47)45-24-17-34(42-20-7-2-8-21-42)27-39(45,32-12-9-11-30(26-32)35-13-5-6-19-40-35)43-22-15-33(16-23-43)44-28-31-10-3-4-14-36(31)41-38(44)48/h3-6,9-14,19,25-26,29,33-34H,2,7-8,15-18,20-24,27-28H2,1H3,(H,41,48)