3-methyl-2-phenylazanyl-4-pyridin-3-yloxy-1-(2-quinazolin-6-ylethynyl)piperidin-4-ol

Systemtic Name: 3-methyl-2-phenylazanyl-4-pyridin-3-yloxy-1-(2-quinazolin-6-ylethynyl)piperidin-4-ol Openeye Name: 2-anilino-3-methyl-4-(3-pyridyloxy)-1-(2-quinazolin-6-ylethynyl)piperidin-4-ol CAS Name: 2-anilino-3-methyl-4-(3-pyridinyloxy)-1-[2-(6-quinazolinyl)ethynyl]-4-piperidinol IUPAC Name: 2-anilino-3-methyl-4-pyridin-3-yloxy-1-(2-quinazolin-6-ylethynyl)piperidin-4-ol Traditional Name: 2-anilino-3-methyl-4-(3-pyridyloxy)-1-(2-quinazolin-6-ylethynyl)piperidin-4-ol Formula: C27H25N5O2 MolecularWeight: 451.5197

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(N(CCC1(O)OC2=CN=CC=C2)C#CC3=CC4=CN=CN=C4C=C3)NC5=CC=CC=C5

Isomeric SMILES

CC1C(N(CCC1(O)OC2=CN=CC=C2)C#CC3=CC4=CN=CN=C4C=C3)NC5=CC=CC=C5

InChI

InChI=1S/C27H25N5O2/c1-20-26(31-23-6-3-2-4-7-23)32(15-12-27(20,33)34-24-8-5-13-28-18-24)14-11-21-9-10-25-22(16-21)17-29-19-30-25/h2-10,13,16-20,26,31,33H,12,15H2,1H3