2-[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-(3-sulfamoylphenyl)benzamide

Systemtic Name: 2-[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-(3-sulfamoylphenyl)benzamide Openeye Name: 2-[2-(4-fluoroanilino)-2-oxo-ethyl]sulfanyl-N-(3-sulfamoylphenyl)benzamide CAS Name: 2-[[2-(4-fluoroanilino)-2-oxoethyl]thio]-N-(3-sulfamoylphenyl)benzamide IUPAC Name: 2-[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl-N-(3-sulfamoylphenyl)benzamide Traditional Name: 2-[[2-(4-fluoroanilino)-2-keto-ethyl]thio]-N-(3-sulfamoylphenyl)benzamide Formula: C21H18FN3O4S2 MolecularWeight: 459.513723

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NC2=CC(=CC=C2)S(=O)(=O)N)SCC(=O)NC3=CC=C(C=C3)F

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NC2=CC(=CC=C2)S(=O)(=O)N)SCC(=O)NC3=CC=C(C=C3)F

InChI

InChI=1S/C21H18FN3O4S2/c22-14-8-10-15(11-9-14)24-20(26)13-30-19-7-2-1-6-18(19)21(27)25-16-4-3-5-17(12-16)31(23,28)29/h1-12H,13H2,(H,24,26)(H,25,27)(H2,23,28,29)