ethyl 4-[[C-(4-fluorophenyl)-N-(4-methylphenyl)sulfonyl-carbonimidoyl]amino]benzoate

Systemtic Name: ethyl 4-[[C-(4-fluorophenyl)-N-(4-methylphenyl)sulfonyl-carbonimidoyl]amino]benzoate Openeye Name: ethyl 4-[[C-(4-fluorophenyl)-N-(p-tolylsulfonyl)carbonimidoyl]amino]benzoate CAS Name: 4-[[(4-fluorophenyl)-(4-methylphenyl)sulfonyliminomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[C-(4-fluorophenyl)-N-(4-methylphenyl)sulfonylcarbonimidoyl]amino]benzoate Traditional Name: 4-[[C-(4-fluorophenyl)-N-tosyl-carbonimidoyl]amino]benzoic acid ethyl ester Formula: C23H21FN2O4S MolecularWeight: 440.487243

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=NS(=O)(=O)C2=CC=C(C=C2)C)C3=CC=C(C=C3)F

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=NS(=O)(=O)C2=CC=C(C=C2)C)C3=CC=C(C=C3)F

InChI

InChI=1S/C23H21FN2O4S/c1-3-30-23(27)18-8-12-20(13-9-18)25-22(17-6-10-19(24)11-7-17)26-31(28,29)21-14-4-16(2)5-15-21/h4-15H,3H2,1-2H3,(H,25,26)