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

Systemtic Name: 2-[2-[[2-azanyl-5-[2-(4-chlorophenyl)ethynyl]pyrimidin-4-yl]amino]ethoxy]ethanol Openeye Name: 2-[2-[[2-amino-5-[2-(4-chlorophenyl)ethynyl]pyrimidin-4-yl]amino]ethoxy]ethanol CAS Name: 2-[2-[[2-amino-5-[2-(4-chlorophenyl)ethynyl]-4-pyrimidinyl]amino]ethoxy]ethanol IUPAC Name: 2-[2-[[2-amino-5-[2-(4-chlorophenyl)ethynyl]pyrimidin-4-yl]amino]ethoxy]ethanol Traditional Name: 2-[2-[[2-amino-5-[2-(4-chlorophenyl)ethynyl]pyrimidin-4-yl]amino]ethoxy]ethanol Formula: C16H17ClN4O2 MolecularWeight: 332.78478

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#CC2=CN=C(N=C2NCCOCCO)N)Cl

Isomeric SMILES

C1=CC(=CC=C1C#CC2=CN=C(N=C2NCCOCCO)N)Cl

InChI

InChI=1S/C16H17ClN4O2/c17-14-5-2-12(3-6-14)1-4-13-11-20-16(18)21-15(13)19-7-9-23-10-8-22/h2-3,5-6,11,22H,7-10H2,(H3,18,19,20,21)