2-methyl-4-[4-[(3-methyl-4-pyridin-3-yloxy-phenyl)amino]quinazolin-6-yl]but-3-yn-2-ol

Systemtic Name: 2-methyl-4-[4-[(3-methyl-4-pyridin-3-yloxy-phenyl)amino]quinazolin-6-yl]but-3-yn-2-ol Openeye Name: 2-methyl-4-[4-[3-methyl-4-(3-pyridyloxy)anilino]quinazolin-6-yl]but-3-yn-2-ol CAS Name: 2-methyl-4-[4-[3-methyl-4-(3-pyridinyloxy)anilino]-6-quinazolinyl]-3-butyn-2-ol IUPAC Name: 2-methyl-4-[4-(3-methyl-4-pyridin-3-yloxyanilino)quinazolin-6-yl]but-3-yn-2-ol Traditional Name: 2-methyl-4-[4-[3-methyl-4-(3-pyridyloxy)anilino]quinazolin-6-yl]but-3-yn-2-ol Formula: C25H22N4O2 MolecularWeight: 410.46778

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC2=NC=NC3=C2C=C(C=C3)C#CC(C)(C)O)OC4=CN=CC=C4

Isomeric SMILES

CC1=C(C=CC(=C1)NC2=NC=NC3=C2C=C(C=C3)C#CC(C)(C)O)OC4=CN=CC=C4

InChI

InChI=1S/C25H22N4O2/c1-17-13-19(7-9-23(17)31-20-5-4-12-26-15-20)29-24-21-14-18(10-11-25(2,3)30)6-8-22(21)27-16-28-24/h4-9,12-16,30H,1-3H3,(H,27,28,29)