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

Systemtic Name: 4-azanyl-1-[4-[(3-methoxy-4-phenoxy-phenyl)amino]quinazolin-6-yl]-4-methyl-pent-1-yn-3-ol Openeye Name: 4-amino-1-[4-(3-methoxy-4-phenoxy-anilino)quinazolin-6-yl]-4-methyl-pent-1-yn-3-ol CAS Name: 4-amino-1-[4-(3-methoxy-4-phenoxyanilino)-6-quinazolinyl]-4-methyl-1-pentyn-3-ol IUPAC Name: 4-amino-1-[4-(3-methoxy-4-phenoxyanilino)quinazolin-6-yl]-4-methylpent-1-yn-3-ol Traditional Name: 4-amino-1-[4-(3-methoxy-4-phenoxy-anilino)quinazolin-6-yl]-4-methyl-pent-1-yn-3-ol Formula: C27H26N4O3 MolecularWeight: 454.52034

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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)OC)O)N

Isomeric SMILES

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

InChI

InChI=1S/C27H26N4O3/c1-27(2,28)25(32)14-10-18-9-12-22-21(15-18)26(30-17-29-22)31-19-11-13-23(24(16-19)33-3)34-20-7-5-4-6-8-20/h4-9,11-13,15-17,25,32H,28H2,1-3H3,(H,29,30,31)