1-[3-ethyl-1-[4-[[3-methyl-4-(6-methylpyridin-3-yl)oxy-phenyl]amino]quinazolin-6-yl]-5-oxidanyl-pent-1-yn-3-yl]urea

Systemtic Name: 1-[3-ethyl-1-[4-[[3-methyl-4-(6-methylpyridin-3-yl)oxy-phenyl]amino]quinazolin-6-yl]-5-oxidanyl-pent-1-yn-3-yl]urea Openeye Name: [1-ethyl-1-(2-hydroxyethyl)-3-[4-[3-methyl-4-[(6-methyl-3-pyridyl)oxy]anilino]quinazolin-6-yl]prop-2-ynyl]urea CAS Name: [3-ethyl-5-hydroxy-1-[4-[3-methyl-4-[(6-methyl-3-pyridinyl)oxy]anilino]-6-quinazolinyl]pent-1-yn-3-yl]urea IUPAC Name: [3-ethyl-5-hydroxy-1-[4-[3-methyl-4-(6-methylpyridin-3-yl)oxyanilino]quinazolin-6-yl]pent-1-yn-3-yl]urea Traditional Name: [1-ethyl-1-(2-hydroxyethyl)-3-[4-[3-methyl-4-[(6-methyl-3-pyridyl)oxy]anilino]quinazolin-6-yl]prop-2-ynyl]urea Formula: C29H30N6O3 MolecularWeight: 510.5869

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H30N6O3/c1-4-29(13-14-36,35-28(30)37)12-11-21-6-9-25-24(16-21)27(33-18-32-25)34-22-7-10-26(19(2)15-22)38-23-8-5-20(3)31-17-23/h5-10,15-18,36H,4,13-14H2,1-3H3,(H3,30,35,37)(H,32,33,34)