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

Systemtic Name: N-[(E)-3-[4-[(4,5-dimethyl-2-pyridin-3-yloxy-phenyl)amino]quinazolin-6-yl]prop-2-enyl]ethanamide Openeye Name: N-[(E)-3-[4-[4,5-dimethyl-2-(3-pyridyloxy)anilino]quinazolin-6-yl]allyl]acetamide CAS Name: N-[(E)-3-[4-[4,5-dimethyl-2-(3-pyridinyloxy)anilino]-6-quinazolinyl]prop-2-enyl]acetamide IUPAC Name: N-[(E)-3-[4-(4,5-dimethyl-2-pyridin-3-yloxyanilino)quinazolin-6-yl]prop-2-enyl]acetamide Traditional Name: N-[(E)-3-[4-[4,5-dimethyl-2-(3-pyridyloxy)anilino]quinazolin-6-yl]allyl]acetamide Formula: C26H25N5O2 MolecularWeight: 439.509

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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)C

Isomeric SMILES

CC1=CC(=C(C=C1C)OC2=CN=CC=C2)NC3=NC=NC4=C3C=C(C=C4)/C=C/CNC(=O)C

InChI

InChI=1S/C26H25N5O2/c1-17-12-24(25(13-18(17)2)33-21-7-5-10-27-15-21)31-26-22-14-20(6-4-11-28-19(3)32)8-9-23(22)29-16-30-26/h4-10,12-16H,11H2,1-3H3,(H,28,32)(H,29,30,31)/b6-4+