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

Systemtic Name: N-[4-[4-[(3-methoxy-4-phenoxy-phenyl)amino]quinazolin-6-yl]-2-methyl-but-3-yn-2-yl]methanesulfonamide Openeye Name: N-[3-[4-(3-methoxy-4-phenoxy-anilino)quinazolin-6-yl]-1,1-dimethyl-prop-2-ynyl]methanesulfonamide CAS Name: N-[4-[4-(3-methoxy-4-phenoxyanilino)-6-quinazolinyl]-2-methylbut-3-yn-2-yl]methanesulfonamide IUPAC Name: N-[4-[4-(3-methoxy-4-phenoxyanilino)quinazolin-6-yl]-2-methylbut-3-yn-2-yl]methanesulfonamide Traditional Name: N-[3-[4-(3-methoxy-4-phenoxy-anilino)quinazolin-6-yl]-1,1-dimethyl-prop-2-ynyl]methanesulfonamide Formula: C27H26N4O4S MolecularWeight: 502.58474

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#CC1=CC2=C(C=C1)N=CN=C2NC3=CC(=C(C=C3)OC4=CC=CC=C4)OC)NS(=O)(=O)C

Isomeric SMILES

CC(C)(C#CC1=CC2=C(C=C1)N=CN=C2NC3=CC(=C(C=C3)OC4=CC=CC=C4)OC)NS(=O)(=O)C

InChI

InChI=1S/C27H26N4O4S/c1-27(2,31-36(4,32)33)15-14-19-10-12-23-22(16-19)26(29-18-28-23)30-20-11-13-24(25(17-20)34-3)35-21-8-6-5-7-9-21/h5-13,16-18,31H,1-4H3,(H,28,29,30)