5-(5-ethynyl-4-fluoranyl-2-propan-2-yl-phenoxy)pyrimidine-2,4-diamine

Systemtic Name: 5-(5-ethynyl-4-fluoranyl-2-propan-2-yl-phenoxy)pyrimidine-2,4-diamine Openeye Name: 5-(5-ethynyl-4-fluoro-2-isopropyl-phenoxy)pyrimidine-2,4-diamine CAS Name: 5-(5-ethynyl-4-fluoro-2-propan-2-ylphenoxy)pyrimidine-2,4-diamine IUPAC Name: 5-(5-ethynyl-4-fluoro-2-propan-2-ylphenoxy)pyrimidine-2,4-diamine Traditional Name: [2-amino-5-(5-ethynyl-4-fluoro-2-isopropyl-phenoxy)pyrimidin-4-yl]amine Formula: C15H15FN4O MolecularWeight: 286.304203

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=C(C(=C1)F)C#C)OC2=CN=C(N=C2N)N

Isomeric SMILES

CC(C)C1=C(C=C(C(=C1)F)C#C)OC2=CN=C(N=C2N)N

InChI

InChI=1S/C15H15FN4O/c1-4-9-5-12(10(8(2)3)6-11(9)16)21-13-7-19-15(18)20-14(13)17/h1,5-8H,2-3H3,(H4,17,18,19,20)