4-[(4-tert-butylphenyl)methylsulfanyl]-N-ethyl-6-(trifluoromethyl)pyrimidin-2-amine

Systemtic Name: 4-[(4-tert-butylphenyl)methylsulfanyl]-N-ethyl-6-(trifluoromethyl)pyrimidin-2-amine Openeye Name: 4-[(4-tert-butylphenyl)methylsulfanyl]-N-ethyl-6-(trifluoromethyl)pyrimidin-2-amine CAS Name: 4-[(4-tert-butylphenyl)methylthio]-N-ethyl-6-(trifluoromethyl)-2-pyrimidinamine IUPAC Name: 4-[(4-tert-butylphenyl)methylsulfanyl]-N-ethyl-6-(trifluoromethyl)pyrimidin-2-amine Traditional Name: [4-[(4-tert-butylbenzyl)thio]-6-(trifluoromethyl)pyrimidin-2-yl]-ethyl-amine Formula: C18H22F3N3S MolecularWeight: 369.44759

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NC(=CC(=N1)SCC2=CC=C(C=C2)C(C)(C)C)C(F)(F)F

Isomeric SMILES

CCNC1=NC(=CC(=N1)SCC2=CC=C(C=C2)C(C)(C)C)C(F)(F)F

InChI

InChI=1S/C18H22F3N3S/c1-5-22-16-23-14(18(19,20)21)10-15(24-16)25-11-12-6-8-13(9-7-12)17(2,3)4/h6-10H,5,11H2,1-4H3,(H,22,23,24)