N-[5-[[6-methoxy-7-(2-oxidanyl-3-piperidin-1-yl-propoxy)quinazolin-4-yl]amino]pyrimidin-2-yl]benzamide

Systemtic Name: N-[5-[[6-methoxy-7-(2-oxidanyl-3-piperidin-1-yl-propoxy)quinazolin-4-yl]amino]pyrimidin-2-yl]benzamide Openeye Name: N-[5-[[7-[2-hydroxy-3-(1-piperidyl)propoxy]-6-methoxy-quinazolin-4-yl]amino]pyrimidin-2-yl]benzamide CAS Name: N-[5-[[7-[2-hydroxy-3-(1-piperidinyl)propoxy]-6-methoxy-4-quinazolinyl]amino]-2-pyrimidinyl]benzamide IUPAC Name: N-[5-[[7-(2-hydroxy-3-piperidin-1-ylpropoxy)-6-methoxyquinazolin-4-yl]amino]pyrimidin-2-yl]benzamide Traditional Name: N-[5-[[7-(2-hydroxy-3-piperidino-propoxy)-6-methoxy-quinazolin-4-yl]amino]pyrimidin-2-yl]benzamide Formula: C28H31N7O4 MolecularWeight: 529.59024

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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)OCC(CN5CCCCC5)O

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)NC3=CN=C(N=C3)NC(=O)C4=CC=CC=C4)OCC(CN5CCCCC5)O

InChI

InChI=1S/C28H31N7O4/c1-38-24-12-22-23(13-25(24)39-17-21(36)16-35-10-6-3-7-11-35)31-18-32-26(22)33-20-14-29-28(30-15-20)34-27(37)19-8-4-2-5-9-19/h2,4-5,8-9,12-15,18,21,36H,3,6-7,10-11,16-17H2,1H3,(H,31,32,33)(H,29,30,34,37)