N-(3-methylsulfanylphenyl)-6-[4-(trifluoromethyl)phenyl]pyrimidin-4-amine

Systemtic Name: N-(3-methylsulfanylphenyl)-6-[4-(trifluoromethyl)phenyl]pyrimidin-4-amine Openeye Name: N-(3-methylsulfanylphenyl)-6-[4-(trifluoromethyl)phenyl]pyrimidin-4-amine CAS Name: N-[3-(methylthio)phenyl]-6-[4-(trifluoromethyl)phenyl]-4-pyrimidinamine IUPAC Name: N-(3-methylsulfanylphenyl)-6-[4-(trifluoromethyl)phenyl]pyrimidin-4-amine Traditional Name: [3-(methylthio)phenyl]-[6-[4-(trifluoromethyl)phenyl]pyrimidin-4-yl]amine Formula: C18H14F3N3S MolecularWeight: 361.38407

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)NC2=NC=NC(=C2)C3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

CSC1=CC=CC(=C1)NC2=NC=NC(=C2)C3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C18H14F3N3S/c1-25-15-4-2-3-14(9-15)24-17-10-16(22-11-23-17)12-5-7-13(8-6-12)18(19,20)21/h2-11H,1H3,(H,22,23,24)