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

Systemtic Name: 4-[(4-tert-butylphenyl)methylsulfanyl]-N-methyl-6-(trifluoromethyl)pyrimidin-2-amine Openeye Name: 4-[(4-tert-butylphenyl)methylsulfanyl]-N-methyl-6-(trifluoromethyl)pyrimidin-2-amine CAS Name: 4-[(4-tert-butylphenyl)methylthio]-N-methyl-6-(trifluoromethyl)-2-pyrimidinamine IUPAC Name: 4-[(4-tert-butylphenyl)methylsulfanyl]-N-methyl-6-(trifluoromethyl)pyrimidin-2-amine Traditional Name: [4-[(4-tert-butylbenzyl)thio]-6-(trifluoromethyl)pyrimidin-2-yl]-methyl-amine Formula: C17H20F3N3S MolecularWeight: 355.42101

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CSC2=NC(=NC(=C2)C(F)(F)F)NC

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CSC2=NC(=NC(=C2)C(F)(F)F)NC

InChI

InChI=1S/C17H20F3N3S/c1-16(2,3)12-7-5-11(6-8-12)10-24-14-9-13(17(18,19)20)22-15(21-4)23-14/h5-9H,10H2,1-4H3,(H,21,22,23)