ethyl 4-[(2-fluoranyl-4-thiocyanato-phenyl)sulfamoyl]benzoate

Systemtic Name: ethyl 4-[(2-fluoranyl-4-thiocyanato-phenyl)sulfamoyl]benzoate Openeye Name: ethyl 4-[(2-fluoro-4-thiocyanato-phenyl)sulfamoyl]benzoate CAS Name: 4-[(2-fluoro-4-thiocyanatophenyl)sulfamoyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(2-fluoro-4-thiocyanatophenyl)sulfamoyl]benzoate Traditional Name: 4-[(2-fluoro-4-thiocyanato-phenyl)sulfamoyl]benzoic acid ethyl ester Formula: C16H13FN2O4S2 MolecularWeight: 380.413823

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)NC2=C(C=C(C=C2)SC#N)F

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)NC2=C(C=C(C=C2)SC#N)F

InChI

InChI=1S/C16H13FN2O4S2/c1-2-23-16(20)11-3-6-13(7-4-11)25(21,22)19-15-8-5-12(24-10-18)9-14(15)17/h3-9,19H,2H2,1H3