N-[3-[4-[(4,5-dimethyl-2-pyridin-3-yloxy-phenyl)amino]quinazolin-6-yl]prop-2-ynyl]-2-ethoxy-ethanamide

Systemtic Name: N-[3-[4-[(4,5-dimethyl-2-pyridin-3-yloxy-phenyl)amino]quinazolin-6-yl]prop-2-ynyl]-2-ethoxy-ethanamide Openeye Name: N-[3-[4-[4,5-dimethyl-2-(3-pyridyloxy)anilino]quinazolin-6-yl]prop-2-ynyl]-2-ethoxy-acetamide CAS Name: N-[3-[4-[4,5-dimethyl-2-(3-pyridinyloxy)anilino]-6-quinazolinyl]prop-2-ynyl]-2-ethoxyacetamide IUPAC Name: N-[3-[4-(4,5-dimethyl-2-pyridin-3-yloxyanilino)quinazolin-6-yl]prop-2-ynyl]-2-ethoxyacetamide Traditional Name: N-[3-[4-[4,5-dimethyl-2-(3-pyridyloxy)anilino]quinazolin-6-yl]prop-2-ynyl]-2-ethoxy-acetamide Formula: C28H27N5O3 MolecularWeight: 481.54568

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H27N5O3/c1-4-35-17-27(34)30-12-5-7-21-9-10-24-23(15-21)28(32-18-31-24)33-25-13-19(2)20(3)14-26(25)36-22-8-6-11-29-16-22/h6,8-11,13-16,18H,4,12,17H2,1-3H3,(H,30,34)(H,31,32,33)