S-(6-methyl-2-sulfanylidene-1H-pyrimidin-4-yl) 4-fluoranylbenzenecarbothioate

Systemtic Name: S-(6-methyl-2-sulfanylidene-1H-pyrimidin-4-yl) 4-fluoranylbenzenecarbothioate Openeye Name: S-(6-methyl-2-thioxo-1H-pyrimidin-4-yl) 4-fluorobenzenecarbothioate CAS Name: 4-fluorobenzenecarbothioic acid S-(6-methyl-2-sulfanylidene-1H-pyrimidin-4-yl) ester IUPAC Name: S-(6-methyl-2-sulfanylidene-1H-pyrimidin-4-yl) 4-fluorobenzenecarbothioate Traditional Name: 4-fluorothiobenzoic acid S-(6-methyl-2-thioxo-1H-pyrimidin-4-yl) ester Formula: C12H9FN2OS2 MolecularWeight: 280.341063

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=S)N1)SC(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CC1=CC(=NC(=S)N1)SC(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C12H9FN2OS2/c1-7-6-10(15-12(17)14-7)18-11(16)8-2-4-9(13)5-3-8/h2-6H,1H3,(H,14,15,17)