2-[4-[2-azanyl-5-(2-phenylethynyl)pyrimidin-4-yl]piperazin-1-yl]ethanol

Systemtic Name: 2-[4-[2-azanyl-5-(2-phenylethynyl)pyrimidin-4-yl]piperazin-1-yl]ethanol Openeye Name: 2-[4-[2-amino-5-(2-phenylethynyl)pyrimidin-4-yl]piperazin-1-yl]ethanol CAS Name: 2-[4-[2-amino-5-(2-phenylethynyl)-4-pyrimidinyl]-1-piperazinyl]ethanol IUPAC Name: 2-[4-[2-amino-5-(2-phenylethynyl)pyrimidin-4-yl]piperazin-1-yl]ethanol Traditional Name: 2-[4-[2-amino-5-(2-phenylethynyl)pyrimidin-4-yl]piperazino]ethanol Formula: C18H21N5O MolecularWeight: 323.39224

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCO)C2=NC(=NC=C2C#CC3=CC=CC=C3)N

Isomeric SMILES

C1CN(CCN1CCO)C2=NC(=NC=C2C#CC3=CC=CC=C3)N

InChI

InChI=1S/C18H21N5O/c19-18-20-14-16(7-6-15-4-2-1-3-5-15)17(21-18)23-10-8-22(9-11-23)12-13-24/h1-5,14,24H,8-13H2,(H2,19,20,21)