6-methyl-N4-[4-pyridin-4-ylsulfanyl-3-(trifluoromethyl)phenyl]pyrimidine-2,4-diamine

Systemtic Name: 6-methyl-N4-[4-pyridin-4-ylsulfanyl-3-(trifluoromethyl)phenyl]pyrimidine-2,4-diamine Openeye Name: 6-methyl-N4-[4-(4-pyridylsulfanyl)-3-(trifluoromethyl)phenyl]pyrimidine-2,4-diamine CAS Name: 6-methyl-N4-[4-(pyridin-4-ylthio)-3-(trifluoromethyl)phenyl]pyrimidine-2,4-diamine IUPAC Name: 6-methyl-4-N-[4-pyridin-4-ylsulfanyl-3-(trifluoromethyl)phenyl]pyrimidine-2,4-diamine Traditional Name: (2-amino-6-methyl-pyrimidin-4-yl)-[4-(4-pyridylthio)-3-(trifluoromethyl)phenyl]amine Formula: C17H14F3N5S MolecularWeight: 377.38677

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N)NC2=CC(=C(C=C2)SC3=CC=NC=C3)C(F)(F)F

Isomeric SMILES

CC1=CC(=NC(=N1)N)NC2=CC(=C(C=C2)SC3=CC=NC=C3)C(F)(F)F

InChI

InChI=1S/C17H14F3N5S/c1-10-8-15(25-16(21)23-10)24-11-2-3-14(13(9-11)17(18,19)20)26-12-4-6-22-7-5-12/h2-9H,1H3,(H3,21,23,24,25)