N-[4-[3-methyl-4-[(4-pyridin-3-yloxyphenyl)amino]-4H-quinazolin-6-yl]-1-oxidanyl-but-3-yn-2-yl]ethanamide

Systemtic Name: N-[4-[3-methyl-4-[(4-pyridin-3-yloxyphenyl)amino]-4H-quinazolin-6-yl]-1-oxidanyl-but-3-yn-2-yl]ethanamide Openeye Name: N-[1-(hydroxymethyl)-3-[3-methyl-4-[4-(3-pyridyloxy)anilino]-4H-quinazolin-6-yl]prop-2-ynyl]acetamide CAS Name: N-[1-hydroxy-4-[3-methyl-4-[4-(3-pyridinyloxy)anilino]-4H-quinazolin-6-yl]but-3-yn-2-yl]acetamide IUPAC Name: N-[1-hydroxy-4-[3-methyl-4-(4-pyridin-3-yloxyanilino)-4H-quinazolin-6-yl]but-3-yn-2-yl]acetamide Traditional Name: N-[1-methylol-3-[3-methyl-4-[4-(3-pyridyloxy)anilino]-4H-quinazolin-6-yl]prop-2-ynyl]acetamide Formula: C26H25N5O3 MolecularWeight: 455.5084

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CO)C#CC1=CC2=C(C=C1)N=CN(C2NC3=CC=C(C=C3)OC4=CN=CC=C4)C

Isomeric SMILES

CC(=O)NC(CO)C#CC1=CC2=C(C=C1)N=CN(C2NC3=CC=C(C=C3)OC4=CN=CC=C4)C

InChI

InChI=1S/C26H25N5O3/c1-18(33)29-21(16-32)7-5-19-6-12-25-24(14-19)26(31(2)17-28-25)30-20-8-10-22(11-9-20)34-23-4-3-13-27-15-23/h3-4,6,8-15,17,21,26,30,32H,16H2,1-2H3,(H,29,33)