2-[2-[[2-azanyl-5-(2-phenylethynyl)pyrimidin-4-yl]amino]ethoxy]ethanol

Systemtic Name: 2-[2-[[2-azanyl-5-(2-phenylethynyl)pyrimidin-4-yl]amino]ethoxy]ethanol Openeye Name: 2-[2-[[2-amino-5-(2-phenylethynyl)pyrimidin-4-yl]amino]ethoxy]ethanol CAS Name: 2-[2-[[2-amino-5-(2-phenylethynyl)-4-pyrimidinyl]amino]ethoxy]ethanol IUPAC Name: 2-[2-[[2-amino-5-(2-phenylethynyl)pyrimidin-4-yl]amino]ethoxy]ethanol Traditional Name: 2-[2-[[2-amino-5-(2-phenylethynyl)pyrimidin-4-yl]amino]ethoxy]ethanol Formula: C16H18N4O2 MolecularWeight: 298.33972

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C#CC2=CN=C(N=C2NCCOCCO)N

Isomeric SMILES

C1=CC=C(C=C1)C#CC2=CN=C(N=C2NCCOCCO)N

InChI

InChI=1S/C16H18N4O2/c17-16-19-12-14(7-6-13-4-2-1-3-5-13)15(20-16)18-8-10-22-11-9-21/h1-5,12,21H,8-11H2,(H3,17,18,19,20)