3-chloranyl-N-[5-[[6-methoxy-7-(3-morpholin-4-ylpropoxy)quinazolin-4-yl]amino]pyrimidin-2-yl]benzamide

Systemtic Name: 3-chloranyl-N-[5-[[6-methoxy-7-(3-morpholin-4-ylpropoxy)quinazolin-4-yl]amino]pyrimidin-2-yl]benzamide Openeye Name: 3-chloro-N-[5-[[6-methoxy-7-(3-morpholinopropoxy)quinazolin-4-yl]amino]pyrimidin-2-yl]benzamide CAS Name: 3-chloro-N-[5-[[6-methoxy-7-[3-(4-morpholinyl)propoxy]-4-quinazolinyl]amino]-2-pyrimidinyl]benzamide IUPAC Name: 3-chloro-N-[5-[[6-methoxy-7-(3-morpholin-4-ylpropoxy)quinazolin-4-yl]amino]pyrimidin-2-yl]benzamide Traditional Name: 3-chloro-N-[5-[[6-methoxy-7-(3-morpholinopropoxy)quinazolin-4-yl]amino]pyrimidin-2-yl]benzamide Formula: C27H28ClN7O4 MolecularWeight: 550.00872

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC=N2)NC3=CN=C(N=C3)NC(=O)C4=CC(=CC=C4)Cl)OCCCN5CCOCC5

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)NC3=CN=C(N=C3)NC(=O)C4=CC(=CC=C4)Cl)OCCCN5CCOCC5

InChI

InChI=1S/C27H28ClN7O4/c1-37-23-13-21-22(14-24(23)39-9-3-6-35-7-10-38-11-8-35)31-17-32-25(21)33-20-15-29-27(30-16-20)34-26(36)18-4-2-5-19(28)12-18/h2,4-5,12-17H,3,6-11H2,1H3,(H,31,32,33)(H,29,30,34,36)