4-chloranyl-6-(2-phenylethynyl)pyrimidin-2-amine

Systemtic Name: 4-chloranyl-6-(2-phenylethynyl)pyrimidin-2-amine Openeye Name: 4-chloro-6-(2-phenylethynyl)pyrimidin-2-amine CAS Name: 4-chloro-6-(2-phenylethynyl)-2-pyrimidinamine IUPAC Name: 4-chloro-6-(2-phenylethynyl)pyrimidin-2-amine Traditional Name: [4-chloro-6-(2-phenylethynyl)pyrimidin-2-yl]amine Formula: C12H8ClN3 MolecularWeight: 229.66502

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C#CC2=CC(=NC(=N2)N)Cl

Isomeric SMILES

C1=CC=C(C=C1)C#CC2=CC(=NC(=N2)N)Cl

InChI

InChI=1S/C12H8ClN3/c13-11-8-10(15-12(14)16-11)7-6-9-4-2-1-3-5-9/h1-5,8H,(H2,14,15,16)