6,7-diethoxy-N-(3-ethynyl-5-fluoranyl-phenyl)quinazolin-4-amine

Systemtic Name: 6,7-diethoxy-N-(3-ethynyl-5-fluoranyl-phenyl)quinazolin-4-amine Openeye Name: 6,7-diethoxy-N-(3-ethynyl-5-fluoro-phenyl)quinazolin-4-amine CAS Name: 6,7-diethoxy-N-(3-ethynyl-5-fluorophenyl)-4-quinazolinamine IUPAC Name: 6,7-diethoxy-N-(3-ethynyl-5-fluorophenyl)quinazolin-4-amine Traditional Name: (6,7-diethoxyquinazolin-4-yl)-(3-ethynyl-5-fluoro-phenyl)amine Formula: C20H18FN3O2 MolecularWeight: 351.374223

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)C(=NC=N2)NC3=CC(=CC(=C3)C#C)F)OCC

Isomeric SMILES

CCOC1=C(C=C2C(=C1)C(=NC=N2)NC3=CC(=CC(=C3)C#C)F)OCC

InChI

InChI=1S/C20H18FN3O2/c1-4-13-7-14(21)9-15(8-13)24-20-16-10-18(25-5-2)19(26-6-3)11-17(16)22-12-23-20/h1,7-12H,5-6H2,2-3H3,(H,22,23,24)