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

Systemtic Name: N-[4-[4-[(3-chloranyl-4-phenoxy-phenyl)amino]quinazolin-6-yl]-2-methyl-but-3-yn-2-yl]methanesulfonamide Openeye Name: N-[3-[4-(3-chloro-4-phenoxy-anilino)quinazolin-6-yl]-1,1-dimethyl-prop-2-ynyl]methanesulfonamide CAS Name: N-[4-[4-(3-chloro-4-phenoxyanilino)-6-quinazolinyl]-2-methylbut-3-yn-2-yl]methanesulfonamide IUPAC Name: N-[4-[4-(3-chloro-4-phenoxyanilino)quinazolin-6-yl]-2-methylbut-3-yn-2-yl]methanesulfonamide Traditional Name: N-[3-[4-(3-chloro-4-phenoxy-anilino)quinazolin-6-yl]-1,1-dimethyl-prop-2-ynyl]methanesulfonamide Formula: C26H23ClN4O3S MolecularWeight: 507.00382

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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)Cl)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)Cl)NS(=O)(=O)C

InChI

InChI=1S/C26H23ClN4O3S/c1-26(2,31-35(3,32)33)14-13-18-9-11-23-21(15-18)25(29-17-28-23)30-19-10-12-24(22(27)16-19)34-20-7-5-4-6-8-20/h4-12,15-17,31H,1-3H3,(H,28,29,30)