N-[3-[4-[(3-methyl-4-pyridin-3-yloxy-phenyl)amino]quinazolin-6-yl]prop-2-ynyl]-2-oxidanyl-propanamide

Systemtic Name: N-[3-[4-[(3-methyl-4-pyridin-3-yloxy-phenyl)amino]quinazolin-6-yl]prop-2-ynyl]-2-oxidanyl-propanamide Openeye Name: 2-hydroxy-N-[3-[4-[3-methyl-4-(3-pyridyloxy)anilino]quinazolin-6-yl]prop-2-ynyl]propanamide CAS Name: 2-hydroxy-N-[3-[4-[3-methyl-4-(3-pyridinyloxy)anilino]-6-quinazolinyl]prop-2-ynyl]propanamide IUPAC Name: 2-hydroxy-N-[3-[4-(3-methyl-4-pyridin-3-yloxyanilino)quinazolin-6-yl]prop-2-ynyl]propanamide Traditional Name: 2-hydroxy-N-[3-[4-[3-methyl-4-(3-pyridyloxy)anilino]quinazolin-6-yl]prop-2-ynyl]propionamide Formula: C26H23N5O3 MolecularWeight: 453.49252

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H23N5O3/c1-17-13-20(8-10-24(17)34-21-6-4-11-27-15-21)31-25-22-14-19(7-9-23(22)29-16-30-25)5-3-12-28-26(33)18(2)32/h4,6-11,13-16,18,32H,12H2,1-2H3,(H,28,33)(H,29,30,31)