3-[[5-fluoranyl-2-[[4-(2-methyl-1-oxidanyl-propan-2-yl)phenyl]amino]pyrimidin-4-yl]amino]phenol

Systemtic Name: 3-[[5-fluoranyl-2-[[4-(2-methyl-1-oxidanyl-propan-2-yl)phenyl]amino]pyrimidin-4-yl]amino]phenol Openeye Name: 3-[[5-fluoro-2-[4-(2-hydroxy-1,1-dimethyl-ethyl)anilino]pyrimidin-4-yl]amino]phenol CAS Name: 3-[[5-fluoro-2-[4-(1-hydroxy-2-methylpropan-2-yl)anilino]-4-pyrimidinyl]amino]phenol IUPAC Name: 3-[[5-fluoro-2-[4-(1-hydroxy-2-methylpropan-2-yl)anilino]pyrimidin-4-yl]amino]phenol Traditional Name: 3-[[5-fluoro-2-[4-(2-hydroxy-1,1-dimethyl-ethyl)anilino]pyrimidin-4-yl]amino]phenol Formula: C20H21FN4O2 MolecularWeight: 368.404743

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CO)C1=CC=C(C=C1)NC2=NC=C(C(=N2)NC3=CC(=CC=C3)O)F

Isomeric SMILES

CC(C)(CO)C1=CC=C(C=C1)NC2=NC=C(C(=N2)NC3=CC(=CC=C3)O)F

InChI

InChI=1S/C20H21FN4O2/c1-20(2,12-26)13-6-8-14(9-7-13)24-19-22-11-17(21)18(25-19)23-15-4-3-5-16(27)10-15/h3-11,26-27H,12H2,1-2H3,(H2,22,23,24,25)