4-methyl-2-[4-nitro-3-(trifluoromethyl)phenyl]sulfanyl-pyrimidine

Systemtic Name: 4-methyl-2-[4-nitro-3-(trifluoromethyl)phenyl]sulfanyl-pyrimidine Openeye Name: 4-methyl-2-[4-nitro-3-(trifluoromethyl)phenyl]sulfanyl-pyrimidine CAS Name: 4-methyl-2-[[4-nitro-3-(trifluoromethyl)phenyl]thio]pyrimidine IUPAC Name: 4-methyl-2-[4-nitro-3-(trifluoromethyl)phenyl]sulfanylpyrimidine Traditional Name: 4-methyl-2-[[4-nitro-3-(trifluoromethyl)phenyl]thio]pyrimidine Formula: C12H8F3N3O2S MolecularWeight: 315.27103

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1)SC2=CC(=C(C=C2)[N+](=O)[O-])C(F)(F)F

Isomeric SMILES

CC1=NC(=NC=C1)SC2=CC(=C(C=C2)[N+](=O)[O-])C(F)(F)F

InChI

InChI=1S/C12H8F3N3O2S/c1-7-4-5-16-11(17-7)21-8-2-3-10(18(19)20)9(6-8)12(13,14)15/h2-6H,1H3