5-methyl-2-methylsulfanyl-6-quinolin-7-yl-N-[4-(trifluoromethyl)phenyl]pyrimidin-4-amine

Systemtic Name: 5-methyl-2-methylsulfanyl-6-quinolin-7-yl-N-[4-(trifluoromethyl)phenyl]pyrimidin-4-amine Openeye Name: 5-methyl-2-methylsulfanyl-6-(7-quinolyl)-N-[4-(trifluoromethyl)phenyl]pyrimidin-4-amine CAS Name: 5-methyl-2-(methylthio)-6-(7-quinolinyl)-N-[4-(trifluoromethyl)phenyl]-4-pyrimidinamine IUPAC Name: 5-methyl-2-methylsulfanyl-6-quinolin-7-yl-N-[4-(trifluoromethyl)phenyl]pyrimidin-4-amine Traditional Name: [5-methyl-2-(methylthio)-6-(7-quinolyl)pyrimidin-4-yl]-[4-(trifluoromethyl)phenyl]amine Formula: C22H17F3N4S MolecularWeight: 426.45739

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N=C1NC2=CC=C(C=C2)C(F)(F)F)SC)C3=CC4=C(C=CC=N4)C=C3

Isomeric SMILES

CC1=C(N=C(N=C1NC2=CC=C(C=C2)C(F)(F)F)SC)C3=CC4=C(C=CC=N4)C=C3

InChI

InChI=1S/C22H17F3N4S/c1-13-19(15-6-5-14-4-3-11-26-18(14)12-15)28-21(30-2)29-20(13)27-17-9-7-16(8-10-17)22(23,24)25/h3-12H,1-2H3,(H,27,28,29)