N-[[3-[(2-chlorophenyl)sulfamoyl]-4-methyl-phenyl]carbamothioyl]-4-fluoranyl-benzamide

Systemtic Name: N-[[3-[(2-chlorophenyl)sulfamoyl]-4-methyl-phenyl]carbamothioyl]-4-fluoranyl-benzamide Openeye Name: N-[[3-[(2-chlorophenyl)sulfamoyl]-4-methyl-phenyl]carbamothioyl]-4-fluoro-benzamide CAS Name: N-[[3-[(2-chlorophenyl)sulfamoyl]-4-methylanilino]-sulfanylidenemethyl]-4-fluorobenzamide IUPAC Name: N-[[3-[(2-chlorophenyl)sulfamoyl]-4-methylphenyl]carbamothioyl]-4-fluorobenzamide Traditional Name: N-[[3-[(2-chlorophenyl)sulfamoyl]-4-methyl-phenyl]thiocarbamoyl]-4-fluoro-benzamide Formula: C21H17ClFN3O3S2 MolecularWeight: 477.959383

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)NC(=O)C2=CC=C(C=C2)F)S(=O)(=O)NC3=CC=CC=C3Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)NC(=O)C2=CC=C(C=C2)F)S(=O)(=O)NC3=CC=CC=C3Cl

InChI

InChI=1S/C21H17ClFN3O3S2/c1-13-6-11-16(24-21(30)25-20(27)14-7-9-15(23)10-8-14)12-19(13)31(28,29)26-18-5-3-2-4-17(18)22/h2-12,26H,1H3,(H2,24,25,27,30)