4-fluoranyl-N-[methyl(phenylsulfonyl)amino]-N'-(4-methylsulfonylphenyl)benzenecarboximidamide

Systemtic Name: 4-fluoranyl-N-[methyl(phenylsulfonyl)amino]-N'-(4-methylsulfonylphenyl)benzenecarboximidamide Openeye Name: N-[benzenesulfonyl(methyl)amino]-4-fluoro-N'-(4-methylsulfonylphenyl)benzamidine CAS Name: N-[benzenesulfonyl(methyl)amino]-4-fluoro-N'-(4-methylsulfonylphenyl)benzenecarboximidamide IUPAC Name: N-[benzenesulfonyl(methyl)amino]-4-fluoro-N'-(4-methylsulfonylphenyl)benzenecarboximidamide Traditional Name: N-[besyl(methyl)amino]-4-fluoro-N'-(4-mesylphenyl)benzamidine Formula: C21H20FN3O4S2 MolecularWeight: 461.529603

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Descriptors Computed from Structure

Canonical SMILES:

CN(NC(=NC1=CC=C(C=C1)S(=O)(=O)C)C2=CC=C(C=C2)F)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CN(NC(=NC1=CC=C(C=C1)S(=O)(=O)C)C2=CC=C(C=C2)F)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H20FN3O4S2/c1-25(31(28,29)20-6-4-3-5-7-20)24-21(16-8-10-17(22)11-9-16)23-18-12-14-19(15-13-18)30(2,26)27/h3-15H,1-2H3,(H,23,24)