4-azanyl-6-methylsulfanyl-2-[4-(trifluoromethyl)phenyl]pyrimidine-5-carbonitrile

Systemtic Name: 4-azanyl-6-methylsulfanyl-2-[4-(trifluoromethyl)phenyl]pyrimidine-5-carbonitrile Openeye Name: 4-amino-6-methylsulfanyl-2-[4-(trifluoromethyl)phenyl]pyrimidine-5-carbonitrile CAS Name: 4-amino-6-(methylthio)-2-[4-(trifluoromethyl)phenyl]-5-pyrimidinecarbonitrile IUPAC Name: 4-amino-6-methylsulfanyl-2-[4-(trifluoromethyl)phenyl]pyrimidine-5-carbonitrile Traditional Name: 4-amino-6-(methylthio)-2-[4-(trifluoromethyl)phenyl]pyrimidine-5-carbonitrile Formula: C13H9F3N4S MolecularWeight: 310.29757

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=NC(=C1C#N)N)C2=CC=C(C=C2)C(F)(F)F

Isomeric SMILES

CSC1=NC(=NC(=C1C#N)N)C2=CC=C(C=C2)C(F)(F)F

InChI

InChI=1S/C13H9F3N4S/c1-21-12-9(6-17)10(18)19-11(20-12)7-2-4-8(5-3-7)13(14,15)16/h2-5H,1H3,(H2,18,19,20)