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

Systemtic Name: 2-[2-azanyl-5-[2-(4-chlorophenyl)ethynyl]pyrimidin-4-yl]oxyethanol Openeye Name: 2-[2-amino-5-[2-(4-chlorophenyl)ethynyl]pyrimidin-4-yl]oxyethanol CAS Name: 2-[[2-amino-5-[2-(4-chlorophenyl)ethynyl]-4-pyrimidinyl]oxy]ethanol IUPAC Name: 2-[2-amino-5-[2-(4-chlorophenyl)ethynyl]pyrimidin-4-yl]oxyethanol Traditional Name: 2-[2-amino-5-[2-(4-chlorophenyl)ethynyl]pyrimidin-4-yl]oxyethanol Formula: C14H12ClN3O2 MolecularWeight: 289.71698

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#CC2=CN=C(N=C2OCCO)N)Cl

Isomeric SMILES

C1=CC(=CC=C1C#CC2=CN=C(N=C2OCCO)N)Cl

InChI

InChI=1S/C14H12ClN3O2/c15-12-5-2-10(3-6-12)1-4-11-9-17-14(16)18-13(11)20-8-7-19/h2-3,5-6,9,19H,7-8H2,(H2,16,17,18)