2-[2-[2-azanyl-5-[2-(4-chlorophenyl)ethynyl]pyrimidin-4-yl]oxyethoxy]ethanol

Systemtic Name: 2-[2-[2-azanyl-5-[2-(4-chlorophenyl)ethynyl]pyrimidin-4-yl]oxyethoxy]ethanol Openeye Name: 2-[2-[2-amino-5-[2-(4-chlorophenyl)ethynyl]pyrimidin-4-yl]oxyethoxy]ethanol CAS Name: 2-[2-[[2-amino-5-[2-(4-chlorophenyl)ethynyl]-4-pyrimidinyl]oxy]ethoxy]ethanol IUPAC Name: 2-[2-[2-amino-5-[2-(4-chlorophenyl)ethynyl]pyrimidin-4-yl]oxyethoxy]ethanol Traditional Name: 2-[2-[2-amino-5-[2-(4-chlorophenyl)ethynyl]pyrimidin-4-yl]oxyethoxy]ethanol Formula: C16H16ClN3O3 MolecularWeight: 333.76954

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#CC2=CN=C(N=C2OCCOCCO)N)Cl

Isomeric SMILES

C1=CC(=CC=C1C#CC2=CN=C(N=C2OCCOCCO)N)Cl

InChI

InChI=1S/C16H16ClN3O3/c17-14-5-2-12(3-6-14)1-4-13-11-19-16(18)20-15(13)23-10-9-22-8-7-21/h2-3,5-6,11,21H,7-10H2,(H2,18,19,20)