3-fluoranyl-4-[(6-methoxy-7-phenylmethoxy-quinazolin-4-yl)amino]benzenecarbonitrile

Systemtic Name: 3-fluoranyl-4-[(6-methoxy-7-phenylmethoxy-quinazolin-4-yl)amino]benzenecarbonitrile Openeye Name: 4-[(7-benzyloxy-6-methoxy-quinazolin-4-yl)amino]-3-fluoro-benzonitrile CAS Name: 3-fluoro-4-[(6-methoxy-7-phenylmethoxy-4-quinazolinyl)amino]benzonitrile IUPAC Name: 3-fluoro-4-[(6-methoxy-7-phenylmethoxyquinazolin-4-yl)amino]benzonitrile Traditional Name: 4-[(7-benzoxy-6-methoxy-quinazolin-4-yl)amino]-3-fluoro-benzonitrile Formula: C23H17FN4O2 MolecularWeight: 400.405083

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC=N2)NC3=C(C=C(C=C3)C#N)F)OCC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)NC3=C(C=C(C=C3)C#N)F)OCC4=CC=CC=C4

InChI

InChI=1S/C23H17FN4O2/c1-29-21-10-17-20(11-22(21)30-13-15-5-3-2-4-6-15)26-14-27-23(17)28-19-8-7-16(12-25)9-18(19)24/h2-11,14H,13H2,1H3,(H,26,27,28)