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

Systemtic Name: 3-chloranyl-N-[5-[[6-methoxy-7-(oxiran-2-ylmethoxy)quinazolin-4-yl]amino]pyrimidin-2-yl]benzamide Openeye Name: 3-chloro-N-[5-[[6-methoxy-7-(oxiran-2-ylmethoxy)quinazolin-4-yl]amino]pyrimidin-2-yl]benzamide CAS Name: 3-chloro-N-[5-[[6-methoxy-7-(2-oxiranylmethoxy)-4-quinazolinyl]amino]-2-pyrimidinyl]benzamide IUPAC Name: 3-chloro-N-[5-[[6-methoxy-7-(oxiran-2-ylmethoxy)quinazolin-4-yl]amino]pyrimidin-2-yl]benzamide Traditional Name: 3-chloro-N-[5-[(7-glycidoxy-6-methoxy-quinazolin-4-yl)amino]pyrimidin-2-yl]benzamide Formula: C23H19ClN6O4 MolecularWeight: 478.88776

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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)OCC5CO5

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)NC3=CN=C(N=C3)NC(=O)C4=CC(=CC=C4)Cl)OCC5CO5

InChI

InChI=1S/C23H19ClN6O4/c1-32-19-6-17-18(7-20(19)34-11-16-10-33-16)27-12-28-21(17)29-15-8-25-23(26-9-15)30-22(31)13-3-2-4-14(24)5-13/h2-9,12,16H,10-11H2,1H3,(H,27,28,29)(H,25,26,30,31)