1-[3-[2-[4-[(3-methyl-4-phenoxy-phenyl)amino]quinazolin-6-yl]ethynyl]azetidin-1-yl]ethanone

Systemtic Name: 1-[3-[2-[4-[(3-methyl-4-phenoxy-phenyl)amino]quinazolin-6-yl]ethynyl]azetidin-1-yl]ethanone Openeye Name: 1-[3-[2-[4-(3-methyl-4-phenoxy-anilino)quinazolin-6-yl]ethynyl]azetidin-1-yl]ethanone CAS Name: 1-[3-[2-[4-(3-methyl-4-phenoxyanilino)-6-quinazolinyl]ethynyl]-1-azetidinyl]ethanone IUPAC Name: 1-[3-[2-[4-(3-methyl-4-phenoxyanilino)quinazolin-6-yl]ethynyl]azetidin-1-yl]ethanone Traditional Name: 1-[3-[2-[4-(3-methyl-4-phenoxy-anilino)quinazolin-6-yl]ethynyl]azetidin-1-yl]ethanone Formula: C28H24N4O2 MolecularWeight: 448.51576

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC2=NC=NC3=C2C=C(C=C3)C#CC4CN(C4)C(=O)C)OC5=CC=CC=C5

Isomeric SMILES

CC1=C(C=CC(=C1)NC2=NC=NC3=C2C=C(C=C3)C#CC4CN(C4)C(=O)C)OC5=CC=CC=C5

InChI

InChI=1S/C28H24N4O2/c1-19-14-23(11-13-27(19)34-24-6-4-3-5-7-24)31-28-25-15-21(10-12-26(25)29-18-30-28)8-9-22-16-32(17-22)20(2)33/h3-7,10-15,18,22H,16-17H2,1-2H3,(H,29,30,31)