1-cyclobutyl-3-[4-[(3-methyl-4-phenoxy-phenyl)amino]quinazolin-6-yl]prop-2-yn-1-ol

Systemtic Name: 1-cyclobutyl-3-[4-[(3-methyl-4-phenoxy-phenyl)amino]quinazolin-6-yl]prop-2-yn-1-ol Openeye Name: 1-cyclobutyl-3-[4-(3-methyl-4-phenoxy-anilino)quinazolin-6-yl]prop-2-yn-1-ol CAS Name: 1-cyclobutyl-3-[4-(3-methyl-4-phenoxyanilino)-6-quinazolinyl]-2-propyn-1-ol IUPAC Name: 1-cyclobutyl-3-[4-(3-methyl-4-phenoxyanilino)quinazolin-6-yl]prop-2-yn-1-ol Traditional Name: 1-cyclobutyl-3-[4-(3-methyl-4-phenoxy-anilino)quinazolin-6-yl]prop-2-yn-1-ol Formula: C28H25N3O2 MolecularWeight: 435.517

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC2=NC=NC3=C2C=C(C=C3)C#CC(C4CCC4)O)OC5=CC=CC=C5

Isomeric SMILES

CC1=C(C=CC(=C1)NC2=NC=NC3=C2C=C(C=C3)C#CC(C4CCC4)O)OC5=CC=CC=C5

InChI

InChI=1S/C28H25N3O2/c1-19-16-22(12-15-27(19)33-23-8-3-2-4-9-23)31-28-24-17-20(10-13-25(24)29-18-30-28)11-14-26(32)21-6-5-7-21/h2-4,8-10,12-13,15-18,21,26,32H,5-7H2,1H3,(H,29,30,31)