2-(azetidin-1-yl)-N-[4-methyl-3-[6-(4-methyl-1,4-diazepan-1-yl)-4-oxidanylidene-quinazolin-3-yl]phenyl]pyridine-4-carboxamide

Systemtic Name: 2-(azetidin-1-yl)-N-[4-methyl-3-[6-(4-methyl-1,4-diazepan-1-yl)-4-oxidanylidene-quinazolin-3-yl]phenyl]pyridine-4-carboxamide Openeye Name: 2-(azetidin-1-yl)-N-[4-methyl-3-[6-(4-methyl-1,4-diazepan-1-yl)-4-oxo-quinazolin-3-yl]phenyl]pyridine-4-carboxamide CAS Name: 2-(1-azetidinyl)-N-[4-methyl-3-[6-(4-methyl-1,4-diazepan-1-yl)-4-oxo-3-quinazolinyl]phenyl]-4-pyridinecarboxamide IUPAC Name: 2-(azetidin-1-yl)-N-[4-methyl-3-[6-(4-methyl-1,4-diazepan-1-yl)-4-oxoquinazolin-3-yl]phenyl]pyridine-4-carboxamide Traditional Name: 2-(azetidin-1-yl)-N-[3-[4-keto-6-(4-methyl-1,4-diazepan-1-yl)quinazolin-3-yl]-4-methyl-phenyl]isonicotinamide Formula: C30H33N7O2 MolecularWeight: 523.62872

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC(=NC=C2)N3CCC3)N4C=NC5=C(C4=O)C=C(C=C5)N6CCCN(CC6)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC(=NC=C2)N3CCC3)N4C=NC5=C(C4=O)C=C(C=C5)N6CCCN(CC6)C

InChI

InChI=1S/C30H33N7O2/c1-21-5-6-23(33-29(38)22-9-10-31-28(17-22)36-13-4-14-36)18-27(21)37-20-32-26-8-7-24(19-25(26)30(37)39)35-12-3-11-34(2)15-16-35/h5-10,17-20H,3-4,11-16H2,1-2H3,(H,33,38)