N-[5-[(6-methoxy-7-phenylmethoxy-quinazolin-4-yl)amino]pyrimidin-2-yl]benzamide

Systemtic Name: N-[5-[(6-methoxy-7-phenylmethoxy-quinazolin-4-yl)amino]pyrimidin-2-yl]benzamide Openeye Name: N-[5-[(7-benzyloxy-6-methoxy-quinazolin-4-yl)amino]pyrimidin-2-yl]benzamide CAS Name: N-[5-[(6-methoxy-7-phenylmethoxy-4-quinazolinyl)amino]-2-pyrimidinyl]benzamide IUPAC Name: N-[5-[(6-methoxy-7-phenylmethoxyquinazolin-4-yl)amino]pyrimidin-2-yl]benzamide Traditional Name: N-[5-[(7-benzoxy-6-methoxy-quinazolin-4-yl)amino]pyrimidin-2-yl]benzamide Formula: C27H22N6O3 MolecularWeight: 478.50198

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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)OCC5=CC=CC=C5

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)NC3=CN=C(N=C3)NC(=O)C4=CC=CC=C4)OCC5=CC=CC=C5

InChI

InChI=1S/C27H22N6O3/c1-35-23-12-21-22(13-24(23)36-16-18-8-4-2-5-9-18)30-17-31-25(21)32-20-14-28-27(29-15-20)33-26(34)19-10-6-3-7-11-19/h2-15,17H,16H2,1H3,(H,30,31,32)(H,28,29,33,34)