[5-fluoranyl-2-(4-fluoranyl-2-methyl-phenyl)sulfonyl-phenyl]methyl carbamimidothioate

Systemtic Name: [5-fluoranyl-2-(4-fluoranyl-2-methyl-phenyl)sulfonyl-phenyl]methyl carbamimidothioate Openeye Name: 2-[[5-fluoro-2-(4-fluoro-2-methyl-phenyl)sulfonyl-phenyl]methyl]isothiourea CAS Name: carbamimidothioic acid [5-fluoro-2-(4-fluoro-2-methylphenyl)sulfonylphenyl]methyl ester IUPAC Name: [5-fluoro-2-(4-fluoro-2-methylphenyl)sulfonylphenyl]methyl carbamimidothioate Traditional Name: 2-[5-fluoro-2-(4-fluoro-2-methyl-phenyl)sulfonyl-benzyl]isothiourea Formula: C15H14F2N2O2S2 MolecularWeight: 356.410666

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)F)S(=O)(=O)C2=C(C=C(C=C2)F)CSC(=N)N

Isomeric SMILES

CC1=C(C=CC(=C1)F)S(=O)(=O)C2=C(C=C(C=C2)F)CSC(=N)N

InChI

InChI=1S/C15H14F2N2O2S2/c1-9-6-11(16)2-4-13(9)23(20,21)14-5-3-12(17)7-10(14)8-22-15(18)19/h2-7H,8H2,1H3,(H3,18,19)