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

Systemtic Name: 1-[3-[2-[4-[(3-methoxy-4-phenoxy-phenyl)amino]quinazolin-6-yl]ethynyl]pyrrolidin-1-yl]ethanone Openeye Name: 1-[3-[2-[4-(3-methoxy-4-phenoxy-anilino)quinazolin-6-yl]ethynyl]pyrrolidin-1-yl]ethanone CAS Name: 1-[3-[2-[4-(3-methoxy-4-phenoxyanilino)-6-quinazolinyl]ethynyl]-1-pyrrolidinyl]ethanone IUPAC Name: 1-[3-[2-[4-(3-methoxy-4-phenoxyanilino)quinazolin-6-yl]ethynyl]pyrrolidin-1-yl]ethanone Traditional Name: 1-[3-[2-[4-(3-methoxy-4-phenoxy-anilino)quinazolin-6-yl]ethynyl]pyrrolidino]ethanone Formula: C29H26N4O3 MolecularWeight: 478.54174

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC(C1)C#CC2=CC3=C(C=C2)N=CN=C3NC4=CC(=C(C=C4)OC5=CC=CC=C5)OC

Isomeric SMILES

CC(=O)N1CCC(C1)C#CC2=CC3=C(C=C2)N=CN=C3NC4=CC(=C(C=C4)OC5=CC=CC=C5)OC

InChI

InChI=1S/C29H26N4O3/c1-20(34)33-15-14-22(18-33)9-8-21-10-12-26-25(16-21)29(31-19-30-26)32-23-11-13-27(28(17-23)35-2)36-24-6-4-3-5-7-24/h3-7,10-13,16-17,19,22H,14-15,18H2,1-2H3,(H,30,31,32)