4-azanyl-1-[4-[(3-chloranyl-4-phenoxy-phenyl)amino]quinazolin-6-yl]-4-methyl-pent-1-yn-3-ol

Systemtic Name: 4-azanyl-1-[4-[(3-chloranyl-4-phenoxy-phenyl)amino]quinazolin-6-yl]-4-methyl-pent-1-yn-3-ol Openeye Name: 4-amino-1-[4-(3-chloro-4-phenoxy-anilino)quinazolin-6-yl]-4-methyl-pent-1-yn-3-ol CAS Name: 4-amino-1-[4-(3-chloro-4-phenoxyanilino)-6-quinazolinyl]-4-methyl-1-pentyn-3-ol IUPAC Name: 4-amino-1-[4-(3-chloro-4-phenoxyanilino)quinazolin-6-yl]-4-methylpent-1-yn-3-ol Traditional Name: 4-amino-1-[4-(3-chloro-4-phenoxy-anilino)quinazolin-6-yl]-4-methyl-pent-1-yn-3-ol Formula: C26H23ClN4O2 MolecularWeight: 458.93942

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H23ClN4O2/c1-26(2,28)24(32)13-9-17-8-11-22-20(14-17)25(30-16-29-22)31-18-10-12-23(21(27)15-18)33-19-6-4-3-5-7-19/h3-8,10-12,14-16,24,32H,28H2,1-2H3,(H,29,30,31)