N-tert-butyl-4-[2-(4-fluorophenyl)ethynyl]pyrimidin-2-amine

Systemtic Name: N-tert-butyl-4-[2-(4-fluorophenyl)ethynyl]pyrimidin-2-amine Openeye Name: N-tert-butyl-4-[2-(4-fluorophenyl)ethynyl]pyrimidin-2-amine CAS Name: N-tert-butyl-4-[2-(4-fluorophenyl)ethynyl]-2-pyrimidinamine IUPAC Name: N-tert-butyl-4-[2-(4-fluorophenyl)ethynyl]pyrimidin-2-amine Traditional Name: tert-butyl-[4-[2-(4-fluorophenyl)ethynyl]pyrimidin-2-yl]amine Formula: C16H16FN3 MolecularWeight: 269.316743

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC1=NC=CC(=N1)C#CC2=CC=C(C=C2)F

Isomeric SMILES

CC(C)(C)NC1=NC=CC(=N1)C#CC2=CC=C(C=C2)F

InChI

InChI=1S/C16H16FN3/c1-16(2,3)20-15-18-11-10-14(19-15)9-6-12-4-7-13(17)8-5-12/h4-5,7-8,10-11H,1-3H3,(H,18,19,20)