2-[4-(4-chlorophenyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylethanamine

Systemtic Name: 2-[4-(4-chlorophenyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylethanamine Openeye Name: 2-[4-(4-chlorophenyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylethanamine CAS Name: 2-[[4-(4-chlorophenyl)-6-(trifluoromethyl)-2-pyrimidinyl]thio]ethanamine IUPAC Name: 2-[4-(4-chlorophenyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylethanamine Traditional Name: 2-[[4-(4-chlorophenyl)-6-(trifluoromethyl)pyrimidin-2-yl]thio]ethylamine Formula: C13H11ClF3N3S MolecularWeight: 333.75975

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CC(=NC(=N2)SCCN)C(F)(F)F)Cl

Isomeric SMILES

C1=CC(=CC=C1C2=CC(=NC(=N2)SCCN)C(F)(F)F)Cl

InChI

InChI=1S/C13H11ClF3N3S/c14-9-3-1-8(2-4-9)10-7-11(13(15,16)17)20-12(19-10)21-6-5-18/h1-4,7H,5-6,18H2