2-[4-[[3-chloranyl-4-(pyridin-2-ylmethoxy)phenyl]amino]quinazolin-5-yl]oxy-2-methyl-1-[(3R)-3-oxidanylpyrrolidin-1-yl]propan-1-one

Systemtic Name: 2-[4-[[3-chloranyl-4-(pyridin-2-ylmethoxy)phenyl]amino]quinazolin-5-yl]oxy-2-methyl-1-[(3R)-3-oxidanylpyrrolidin-1-yl]propan-1-one Openeye Name: 2-[4-[3-chloro-4-(2-pyridylmethoxy)anilino]quinazolin-5-yl]oxy-1-[(3R)-3-hydroxypyrrolidin-1-yl]-2-methyl-propan-1-one CAS Name: 2-[[4-[3-chloro-4-(2-pyridinylmethoxy)anilino]-5-quinazolinyl]oxy]-1-[(3R)-3-hydroxy-1-pyrrolidinyl]-2-methyl-1-propanone IUPAC Name: 2-[4-[3-chloro-4-(pyridin-2-ylmethoxy)anilino]quinazolin-5-yl]oxy-1-[(3R)-3-hydroxypyrrolidin-1-yl]-2-methylpropan-1-one Traditional Name: 2-[4-[3-chloro-4-(2-pyridylmethoxy)anilino]quinazolin-5-yl]oxy-1-[(3R)-3-hydroxypyrrolidino]-2-methyl-propan-1-one Formula: C28H28ClN5O4 MolecularWeight: 534.00602

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)N1CCC(C1)O)OC2=CC=CC3=C2C(=NC=N3)NC4=CC(=C(C=C4)OCC5=CC=CC=N5)Cl

Isomeric SMILES

CC(C)(C(=O)N1CC[C@H](C1)O)OC2=CC=CC3=C2C(=NC=N3)NC4=CC(=C(C=C4)OCC5=CC=CC=N5)Cl

InChI

InChI=1S/C28H28ClN5O4/c1-28(2,27(36)34-13-11-20(35)15-34)38-24-8-5-7-22-25(24)26(32-17-31-22)33-18-9-10-23(21(29)14-18)37-16-19-6-3-4-12-30-19/h3-10,12,14,17,20,35H,11,13,15-16H2,1-2H3,(H,31,32,33)/t20-/m1/s1