methyl N'-[2-chloranyl-5-(trifluoromethyl)phenyl]sulfonylcarbamimidothioate

Systemtic Name: methyl N'-[2-chloranyl-5-(trifluoromethyl)phenyl]sulfonylcarbamimidothioate Openeye Name: 3-[2-chloro-5-(trifluoromethyl)phenyl]sulfonyl-2-methyl-isothiourea CAS Name: N'-[2-chloro-5-(trifluoromethyl)phenyl]sulfonylcarbamimidothioic acid methyl ester IUPAC Name: methyl N'-[2-chloro-5-(trifluoromethyl)phenyl]sulfonylcarbamimidothioate Traditional Name: 3-[2-chloro-5-(trifluoromethyl)phenyl]sulfonyl-2-methyl-isothiourea Formula: C9H8ClF3N2O2S2 MolecularWeight: 332.75023

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=NS(=O)(=O)C1=C(C=CC(=C1)C(F)(F)F)Cl)N

Isomeric SMILES

CS/C(=N\S(=O)(=O)C1=C(C=CC(=C1)C(F)(F)F)Cl)/N

InChI

InChI=1S/C9H8ClF3N2O2S2/c1-18-8(14)15-19(16,17)7-4-5(9(11,12)13)2-3-6(7)10/h2-4H,1H3,(H2,14,15)