3-fluoranyl-4-[[6-methoxy-7-[(E)-4-pyrrolidin-1-ylbut-2-enoxy]quinazolin-4-yl]amino]benzenecarbonitrile

Systemtic Name: 3-fluoranyl-4-[[6-methoxy-7-[(E)-4-pyrrolidin-1-ylbut-2-enoxy]quinazolin-4-yl]amino]benzenecarbonitrile Openeye Name: 3-fluoro-4-[[6-methoxy-7-[(E)-4-pyrrolidin-1-ylbut-2-enoxy]quinazolin-4-yl]amino]benzonitrile CAS Name: 3-fluoro-4-[[6-methoxy-7-[(E)-4-(1-pyrrolidinyl)but-2-enoxy]-4-quinazolinyl]amino]benzonitrile IUPAC Name: 3-fluoro-4-[[6-methoxy-7-[(E)-4-pyrrolidin-1-ylbut-2-enoxy]quinazolin-4-yl]amino]benzonitrile Traditional Name: 3-fluoro-4-[[6-methoxy-7-[(E)-4-pyrrolidinobut-2-enoxy]quinazolin-4-yl]amino]benzonitrile Formula: C24H24FN5O2 MolecularWeight: 433.478063

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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)OCC=CCN4CCCC4

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)NC3=C(C=C(C=C3)C#N)F)OC/C=C/CN4CCCC4

InChI

InChI=1S/C24H24FN5O2/c1-31-22-13-18-21(14-23(22)32-11-5-4-10-30-8-2-3-9-30)27-16-28-24(18)29-20-7-6-17(15-26)12-19(20)25/h4-7,12-14,16H,2-3,8-11H2,1H3,(H,27,28,29)/b5-4+