2-methyl-4-[4-[(3-methyl-4-phenoxy-phenyl)amino]quinazolin-6-yl]but-3-yn-2-ol

Systemtic Name: 2-methyl-4-[4-[(3-methyl-4-phenoxy-phenyl)amino]quinazolin-6-yl]but-3-yn-2-ol Openeye Name: 2-methyl-4-[4-(3-methyl-4-phenoxy-anilino)quinazolin-6-yl]but-3-yn-2-ol CAS Name: 2-methyl-4-[4-(3-methyl-4-phenoxyanilino)-6-quinazolinyl]-3-butyn-2-ol IUPAC Name: 2-methyl-4-[4-(3-methyl-4-phenoxyanilino)quinazolin-6-yl]but-3-yn-2-ol Traditional Name: 2-methyl-4-[4-(3-methyl-4-phenoxy-anilino)quinazolin-6-yl]but-3-yn-2-ol Formula: C26H23N3O2 MolecularWeight: 409.47972

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC2=NC=NC3=C2C=C(C=C3)C#CC(C)(C)O)OC4=CC=CC=C4

Isomeric SMILES

CC1=C(C=CC(=C1)NC2=NC=NC3=C2C=C(C=C3)C#CC(C)(C)O)OC4=CC=CC=C4

InChI

InChI=1S/C26H23N3O2/c1-18-15-20(10-12-24(18)31-21-7-5-4-6-8-21)29-25-22-16-19(13-14-26(2,3)30)9-11-23(22)27-17-28-25/h4-12,15-17,30H,1-3H3,(H,27,28,29)