2-[[5-azanyl-6-[2-fluoranyl-4-(trifluoromethyl)phenyl]-2-methyl-pyrimidin-4-yl]amino]-6-methyl-benzenethiol

Systemtic Name: 2-[[5-azanyl-6-[2-fluoranyl-4-(trifluoromethyl)phenyl]-2-methyl-pyrimidin-4-yl]amino]-6-methyl-benzenethiol Openeye Name: 2-[[5-amino-6-[2-fluoro-4-(trifluoromethyl)phenyl]-2-methyl-pyrimidin-4-yl]amino]-6-methyl-benzenethiol CAS Name: 2-[[5-amino-6-[2-fluoro-4-(trifluoromethyl)phenyl]-2-methyl-4-pyrimidinyl]amino]-6-methylbenzenethiol IUPAC Name: 2-[[5-amino-6-[2-fluoro-4-(trifluoromethyl)phenyl]-2-methylpyrimidin-4-yl]amino]-6-methylbenzenethiol Traditional Name: 2-[[5-amino-6-[2-fluoro-4-(trifluoromethyl)phenyl]-2-methyl-pyrimidin-4-yl]amino]-6-methyl-benzenethiol Formula: C19H16F4N4S MolecularWeight: 408.415753

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC2=NC(=NC(=C2N)C3=C(C=C(C=C3)C(F)(F)F)F)C)S

Isomeric SMILES

CC1=C(C(=CC=C1)NC2=NC(=NC(=C2N)C3=C(C=C(C=C3)C(F)(F)F)F)C)S

InChI

InChI=1S/C19H16F4N4S/c1-9-4-3-5-14(17(9)28)27-18-15(24)16(25-10(2)26-18)12-7-6-11(8-13(12)20)19(21,22)23/h3-8,28H,24H2,1-2H3,(H,25,26,27)