S-[2-(4-fluorophenyl)carbonylsulfanyl-6-methyl-pyrimidin-4-yl] 4-fluoranylbenzenecarbothioate

Systemtic Name: S-[2-(4-fluorophenyl)carbonylsulfanyl-6-methyl-pyrimidin-4-yl] 4-fluoranylbenzenecarbothioate Openeye Name: S-[2-(4-fluorobenzoyl)sulfanyl-6-methyl-pyrimidin-4-yl] 4-fluorobenzenecarbothioate CAS Name: 4-fluorobenzenecarbothioic acid S-[2-[[(4-fluorophenyl)-oxomethyl]thio]-6-methyl-4-pyrimidinyl] ester IUPAC Name: S-[2-(4-fluorobenzoyl)sulfanyl-6-methylpyrimidin-4-yl] 4-fluorobenzenecarbothioate Traditional Name: 4-fluorothiobenzoic acid S-[2-[(4-fluorobenzoyl)thio]-6-methyl-pyrimidin-4-yl] ester Formula: C19H12F2N2O2S2 MolecularWeight: 402.437586

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SC(=O)C2=CC=C(C=C2)F)SC(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=CC(=NC(=N1)SC(=O)C2=CC=C(C=C2)F)SC(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C19H12F2N2O2S2/c1-11-10-16(26-17(24)12-2-6-14(20)7-3-12)23-19(22-11)27-18(25)13-4-8-15(21)9-5-13/h2-10H,1H3