N-[3-[7-oxidanylidene-2-(propan-2-ylamino)-1H-quinazolin-6-yl]phenyl]-2-piperidin-1-yl-pyridine-4-carboxamide

Systemtic Name: N-[3-[7-oxidanylidene-2-(propan-2-ylamino)-1H-quinazolin-6-yl]phenyl]-2-piperidin-1-yl-pyridine-4-carboxamide Openeye Name: N-[3-[2-(isopropylamino)-7-oxo-1H-quinazolin-6-yl]phenyl]-2-(1-piperidyl)pyridine-4-carboxamide CAS Name: N-[3-[7-oxo-2-(propan-2-ylamino)-1H-quinazolin-6-yl]phenyl]-2-(1-piperidinyl)-4-pyridinecarboxamide IUPAC Name: N-[3-[7-oxo-2-(propan-2-ylamino)-1H-quinazolin-6-yl]phenyl]-2-piperidin-1-ylpyridine-4-carboxamide Traditional Name: N-[3-[2-(isopropylamino)-7-keto-1H-quinazolin-6-yl]phenyl]-2-piperidino-isonicotinamide Formula: C28H30N6O2 MolecularWeight: 482.5768

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=NC=C2C=C(C(=O)C=C2N1)C3=CC(=CC=C3)NC(=O)C4=CC(=NC=C4)N5CCCCC5

Isomeric SMILES

CC(C)NC1=NC=C2C=C(C(=O)C=C2N1)C3=CC(=CC=C3)NC(=O)C4=CC(=NC=C4)N5CCCCC5

InChI

InChI=1S/C28H30N6O2/c1-18(2)31-28-30-17-21-14-23(25(35)16-24(21)33-28)19-7-6-8-22(13-19)32-27(36)20-9-10-29-26(15-20)34-11-4-3-5-12-34/h6-10,13-18H,3-5,11-12H2,1-2H3,(H,32,36)(H2,30,31,33)