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

Systemtic Name: 2-(dimethylamino)-N-[3-[4-[(3-methyl-4-pyridin-3-yloxy-phenyl)amino]quinazolin-6-yl]prop-2-ynyl]ethanamide Openeye Name: 2-(dimethylamino)-N-[3-[4-[3-methyl-4-(3-pyridyloxy)anilino]quinazolin-6-yl]prop-2-ynyl]acetamide CAS Name: 2-(dimethylamino)-N-[3-[4-[3-methyl-4-(3-pyridinyloxy)anilino]-6-quinazolinyl]prop-2-ynyl]acetamide IUPAC Name: 2-(dimethylamino)-N-[3-[4-(3-methyl-4-pyridin-3-yloxyanilino)quinazolin-6-yl]prop-2-ynyl]acetamide Traditional Name: 2-(dimethylamino)-N-[3-[4-[3-methyl-4-(3-pyridyloxy)anilino]quinazolin-6-yl]prop-2-ynyl]acetamide Formula: C27H26N6O2 MolecularWeight: 466.53434

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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)CN(C)C)OC4=CN=CC=C4

Isomeric SMILES

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

InChI

InChI=1S/C27H26N6O2/c1-19-14-21(9-11-25(19)35-22-7-5-12-28-16-22)32-27-23-15-20(8-10-24(23)30-18-31-27)6-4-13-29-26(34)17-33(2)3/h5,7-12,14-16,18H,13,17H2,1-3H3,(H,29,34)(H,30,31,32)