1-[2-tert-butyl-6-(trifluoromethyl)pyrimidin-4-yl]-1,4-diazepane

Systemtic Name: 1-[2-tert-butyl-6-(trifluoromethyl)pyrimidin-4-yl]-1,4-diazepane Openeye Name: 1-[2-tert-butyl-6-(trifluoromethyl)pyrimidin-4-yl]-1,4-diazepane CAS Name: 1-[2-tert-butyl-6-(trifluoromethyl)-4-pyrimidinyl]-1,4-diazepane IUPAC Name: 1-[2-tert-butyl-6-(trifluoromethyl)pyrimidin-4-yl]-1,4-diazepane Traditional Name: 1-[2-tert-butyl-6-(trifluoromethyl)pyrimidin-4-yl]-1,4-diazepane Formula: C14H21F3N4 MolecularWeight: 302.33855

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC(=CC(=N1)N2CCCNCC2)C(F)(F)F

Isomeric SMILES

CC(C)(C)C1=NC(=CC(=N1)N2CCCNCC2)C(F)(F)F

InChI

InChI=1S/C14H21F3N4/c1-13(2,3)12-19-10(14(15,16)17)9-11(20-12)21-7-4-5-18-6-8-21/h9,18H,4-8H2,1-3H3