3-[4-[(4-phenoxyphenyl)amino]quinazolin-6-yl]-1-pyrrolidin-2-yl-prop-2-yn-1-ol

Systemtic Name: 3-[4-[(4-phenoxyphenyl)amino]quinazolin-6-yl]-1-pyrrolidin-2-yl-prop-2-yn-1-ol Openeye Name: 3-[4-(4-phenoxyanilino)quinazolin-6-yl]-1-pyrrolidin-2-yl-prop-2-yn-1-ol CAS Name: 3-[4-(4-phenoxyanilino)-6-quinazolinyl]-1-(2-pyrrolidinyl)-2-propyn-1-ol IUPAC Name: 3-[4-(4-phenoxyanilino)quinazolin-6-yl]-1-pyrrolidin-2-ylprop-2-yn-1-ol Traditional Name: 3-[4-(4-phenoxyanilino)quinazolin-6-yl]-1-pyrrolidin-2-yl-prop-2-yn-1-ol Formula: C27H24N4O2 MolecularWeight: 436.50506

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(NC1)C(C#CC2=CC3=C(C=C2)N=CN=C3NC4=CC=C(C=C4)OC5=CC=CC=C5)O

Isomeric SMILES

C1CC(NC1)C(C#CC2=CC3=C(C=C2)N=CN=C3NC4=CC=C(C=C4)OC5=CC=CC=C5)O

InChI

InChI=1S/C27H24N4O2/c32-26(25-7-4-16-28-25)15-9-19-8-14-24-23(17-19)27(30-18-29-24)31-20-10-12-22(13-11-20)33-21-5-2-1-3-6-21/h1-3,5-6,8,10-14,17-18,25-26,28,32H,4,7,16H2,(H,29,30,31)