ethyl 4-[2-(4-sulfamoylphenyl)ethylcarbamothioylamino]benzoate

Systemtic Name: ethyl 4-[2-(4-sulfamoylphenyl)ethylcarbamothioylamino]benzoate Openeye Name: ethyl 4-[2-(4-sulfamoylphenyl)ethylcarbamothioylamino]benzoate CAS Name: 4-[[[2-(4-sulfamoylphenyl)ethylamino]-sulfanylidenemethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[2-(4-sulfamoylphenyl)ethylcarbamothioylamino]benzoate Traditional Name: 4-[2-(4-sulfamoylphenyl)ethylthiocarbamoylamino]benzoic acid ethyl ester Formula: C18H21N3O4S2 MolecularWeight: 407.50704

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=S)NCCC2=CC=C(C=C2)S(=O)(=O)N

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=S)NCCC2=CC=C(C=C2)S(=O)(=O)N

InChI

InChI=1S/C18H21N3O4S2/c1-2-25-17(22)14-5-7-15(8-6-14)21-18(26)20-12-11-13-3-9-16(10-4-13)27(19,23)24/h3-10H,2,11-12H2,1H3,(H2,19,23,24)(H2,20,21,26)