3-bromanyl-2-tert-butyl-7-ethylsulfanyl-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine

Systemtic Name: 3-bromanyl-2-tert-butyl-7-ethylsulfanyl-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine Openeye Name: 3-bromo-2-tert-butyl-7-ethylsulfanyl-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine CAS Name: 3-bromo-2-tert-butyl-7-(ethylthio)-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine IUPAC Name: 3-bromo-2-tert-butyl-7-ethylsulfanyl-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine Traditional Name: 3-bromo-2-tert-butyl-7-(ethylthio)-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine Formula: C13H15BrF3N3S MolecularWeight: 382.24251

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC(=NC2=C(C(=NN12)C(C)(C)C)Br)C(F)(F)F

Isomeric SMILES

CCSC1=CC(=NC2=C(C(=NN12)C(C)(C)C)Br)C(F)(F)F

InChI

InChI=1S/C13H15BrF3N3S/c1-5-21-8-6-7(13(15,16)17)18-11-9(14)10(12(2,3)4)19-20(8)11/h6H,5H2,1-4H3