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

Systemtic Name: 4-[4-[(3-methyl-4-pyridin-3-yloxy-phenyl)amino]quinazolin-6-yl]but-3-ynamide Openeye Name: 4-[4-[3-methyl-4-(3-pyridyloxy)anilino]quinazolin-6-yl]but-3-ynamide CAS Name: 4-[4-[3-methyl-4-(3-pyridinyloxy)anilino]-6-quinazolinyl]-3-butynamide IUPAC Name: 4-[4-(3-methyl-4-pyridin-3-yloxyanilino)quinazolin-6-yl]but-3-ynamide Traditional Name: 4-[4-[3-methyl-4-(3-pyridyloxy)anilino]quinazolin-6-yl]but-3-ynamide Formula: C24H19N5O2 MolecularWeight: 409.43996

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H19N5O2/c1-16-12-18(8-10-22(16)31-19-5-3-11-26-14-19)29-24-20-13-17(4-2-6-23(25)30)7-9-21(20)27-15-28-24/h3,5,7-15H,6H2,1H3,(H2,25,30)(H,27,28,29)