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

Systemtic Name: 2-methyl-N-[3-[4-[(3-methyl-4-pyridin-3-yloxy-phenyl)amino]quinazolin-6-yl]prop-2-ynyl]propanamide Openeye Name: 2-methyl-N-[3-[4-[3-methyl-4-(3-pyridyloxy)anilino]quinazolin-6-yl]prop-2-ynyl]propanamide CAS Name: 2-methyl-N-[3-[4-[3-methyl-4-(3-pyridinyloxy)anilino]-6-quinazolinyl]prop-2-ynyl]propanamide IUPAC Name: 2-methyl-N-[3-[4-(3-methyl-4-pyridin-3-yloxyanilino)quinazolin-6-yl]prop-2-ynyl]propanamide Traditional Name: 2-methyl-N-[3-[4-[3-methyl-4-(3-pyridyloxy)anilino]quinazolin-6-yl]prop-2-ynyl]propionamide Formula: C27H25N5O2 MolecularWeight: 451.5197

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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)C)OC4=CN=CC=C4

Isomeric SMILES

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

InChI

InChI=1S/C27H25N5O2/c1-18(2)27(33)29-13-4-6-20-8-10-24-23(15-20)26(31-17-30-24)32-21-9-11-25(19(3)14-21)34-22-7-5-12-28-16-22/h5,7-12,14-18H,13H2,1-3H3,(H,29,33)(H,30,31,32)