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

Systemtic Name: 2-cyano-N-[3-[4-[(4,5-dimethyl-2-pyridin-3-yloxy-phenyl)amino]quinazolin-6-yl]prop-2-ynyl]ethanamide Openeye Name: 2-cyano-N-[3-[4-[4,5-dimethyl-2-(3-pyridyloxy)anilino]quinazolin-6-yl]prop-2-ynyl]acetamide CAS Name: 2-cyano-N-[3-[4-[4,5-dimethyl-2-(3-pyridinyloxy)anilino]-6-quinazolinyl]prop-2-ynyl]acetamide IUPAC Name: 2-cyano-N-[3-[4-(4,5-dimethyl-2-pyridin-3-yloxyanilino)quinazolin-6-yl]prop-2-ynyl]acetamide Traditional Name: 2-cyano-N-[3-[4-[4,5-dimethyl-2-(3-pyridyloxy)anilino]quinazolin-6-yl]prop-2-ynyl]acetamide Formula: C27H22N6O2 MolecularWeight: 462.50258

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C)OC2=CN=CC=C2)NC3=NC=NC4=C3C=C(C=C4)C#CCNC(=O)CC#N

Isomeric SMILES

CC1=CC(=C(C=C1C)OC2=CN=CC=C2)NC3=NC=NC4=C3C=C(C=C4)C#CCNC(=O)CC#N

InChI

InChI=1S/C27H22N6O2/c1-18-13-24(25(14-19(18)2)35-21-6-4-11-29-16-21)33-27-22-15-20(7-8-23(22)31-17-32-27)5-3-12-30-26(34)9-10-28/h4,6-8,11,13-17H,9,12H2,1-2H3,(H,30,34)(H,31,32,33)