2-chloranyl-N-phenyl-5-(2-phenylethynyl)pyrimidin-4-amine

Systemtic Name: 2-chloranyl-N-phenyl-5-(2-phenylethynyl)pyrimidin-4-amine Openeye Name: 2-chloro-N-phenyl-5-(2-phenylethynyl)pyrimidin-4-amine CAS Name: 2-chloro-N-phenyl-5-(2-phenylethynyl)-4-pyrimidinamine IUPAC Name: 2-chloro-N-phenyl-5-(2-phenylethynyl)pyrimidin-4-amine Traditional Name: [2-chloro-5-(2-phenylethynyl)pyrimidin-4-yl]-phenyl-amine Formula: C18H12ClN3 MolecularWeight: 305.76098

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C#CC2=CN=C(N=C2NC3=CC=CC=C3)Cl

Isomeric SMILES

C1=CC=C(C=C1)C#CC2=CN=C(N=C2NC3=CC=CC=C3)Cl

InChI

InChI=1S/C18H12ClN3/c19-18-20-13-15(12-11-14-7-3-1-4-8-14)17(22-18)21-16-9-5-2-6-10-16/h1-10,13H,(H,20,21,22)