4-(2-oxidanylidene-1,4-dihydroquinazolin-3-yl)-1-[3-[(2-phenylphenyl)methyl]-4-piperidin-1-yl-piperidin-4-yl]-2-piperidin-1-yl-butane-1,4-dione

Systemtic Name: 4-(2-oxidanylidene-1,4-dihydroquinazolin-3-yl)-1-[3-[(2-phenylphenyl)methyl]-4-piperidin-1-yl-piperidin-4-yl]-2-piperidin-1-yl-butane-1,4-dione Openeye Name: 4-(2-oxo-1,4-dihydroquinazolin-3-yl)-1-[3-[(2-phenylphenyl)methyl]-4-(1-piperidyl)-4-piperidyl]-2-(1-piperidyl)butane-1,4-dione CAS Name: 4-(2-oxo-1,4-dihydroquinazolin-3-yl)-1-[3-[(2-phenylphenyl)methyl]-4-(1-piperidinyl)-4-piperidinyl]-2-(1-piperidinyl)butane-1,4-dione IUPAC Name: 4-(2-oxo-1,4-dihydroquinazolin-3-yl)-1-[3-[(2-phenylphenyl)methyl]-4-piperidin-1-ylpiperidin-4-yl]-2-piperidin-1-ylbutane-1,4-dione Traditional Name: 4-(2-keto-1,4-dihydroquinazolin-3-yl)-1-[3-(2-phenylbenzyl)-4-piperidino-4-piperidyl]-2-piperidino-butane-1,4-dione Formula: C40H49N5O3 MolecularWeight: 647.84876

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(CC(=O)N2CC3=CC=CC=C3NC2=O)C(=O)C4(CCNCC4CC5=CC=CC=C5C6=CC=CC=C6)N7CCCCC7

Isomeric SMILES

C1CCN(CC1)C(CC(=O)N2CC3=CC=CC=C3NC2=O)C(=O)C4(CCNCC4CC5=CC=CC=C5C6=CC=CC=C6)N7CCCCC7

InChI

InChI=1S/C40H49N5O3/c46-37(45-29-32-17-7-9-19-35(32)42-39(45)48)27-36(43-22-10-2-11-23-43)38(47)40(44-24-12-3-13-25-44)20-21-41-28-33(40)26-31-16-6-8-18-34(31)30-14-4-1-5-15-30/h1,4-9,14-19,33,36,41H,2-3,10-13,20-29H2,(H,42,48)