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

Systemtic Name: ethyl 4-[(2-methyl-4-thiocyanato-phenyl)sulfamoyl]benzoate Openeye Name: ethyl 4-[(2-methyl-4-thiocyanato-phenyl)sulfamoyl]benzoate CAS Name: 4-[(2-methyl-4-thiocyanatophenyl)sulfamoyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(2-methyl-4-thiocyanatophenyl)sulfamoyl]benzoate Traditional Name: 4-[(2-methyl-4-thiocyanato-phenyl)sulfamoyl]benzoic acid ethyl ester Formula: C17H16N2O4S2 MolecularWeight: 376.44994

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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)C

Isomeric SMILES

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

InChI

InChI=1S/C17H16N2O4S2/c1-3-23-17(20)13-4-7-15(8-5-13)25(21,22)19-16-9-6-14(24-11-18)10-12(16)2/h4-10,19H,3H2,1-2H3