1-[[4-[2-[[(2-pyridin-3-ylquinazolin-4-yl)amino]methyl]phenyl]phenyl]methyl]pyrrolidin-2-one

Systemtic Name: 1-[[4-[2-[[(2-pyridin-3-ylquinazolin-4-yl)amino]methyl]phenyl]phenyl]methyl]pyrrolidin-2-one Openeye Name: 1-[[4-[2-[[[2-(3-pyridyl)quinazolin-4-yl]amino]methyl]phenyl]phenyl]methyl]pyrrolidin-2-one CAS Name: 1-[[4-[2-[[[2-(3-pyridinyl)-4-quinazolinyl]amino]methyl]phenyl]phenyl]methyl]-2-pyrrolidinone IUPAC Name: 1-[[4-[2-[[(2-pyridin-3-ylquinazolin-4-yl)amino]methyl]phenyl]phenyl]methyl]pyrrolidin-2-one Traditional Name: 1-[4-[2-[[[2-(3-pyridyl)quinazolin-4-yl]amino]methyl]phenyl]benzyl]-2-pyrrolidone Formula: C31H27N5O MolecularWeight: 485.57898

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)CC2=CC=C(C=C2)C3=CC=CC=C3CNC4=NC(=NC5=CC=CC=C54)C6=CN=CC=C6

Isomeric SMILES

C1CC(=O)N(C1)CC2=CC=C(C=C2)C3=CC=CC=C3CNC4=NC(=NC5=CC=CC=C54)C6=CN=CC=C6

InChI

InChI=1S/C31H27N5O/c37-29-12-6-18-36(29)21-22-13-15-23(16-14-22)26-9-2-1-7-24(26)20-33-31-27-10-3-4-11-28(27)34-30(35-31)25-8-5-17-32-19-25/h1-5,7-11,13-17,19H,6,12,18,20-21H2,(H,33,34,35)