ethyl 4-[[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]carbamothioylamino]benzoate

Systemtic Name: ethyl 4-[[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]carbamothioylamino]benzoate Openeye Name: ethyl 4-[[4-(thiazol-2-ylsulfamoyl)phenyl]carbamothioylamino]benzoate CAS Name: 4-[[sulfanylidene-[4-(2-thiazolylsulfamoyl)anilino]methyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]carbamothioylamino]benzoate Traditional Name: 4-[[4-(thiazol-2-ylsulfamoyl)phenyl]thiocarbamoylamino]benzoic acid ethyl ester Formula: C19H18N4O4S3 MolecularWeight: 462.56562

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CS3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CS3

InChI

InChI=1S/C19H18N4O4S3/c1-2-27-17(24)13-3-5-14(6-4-13)21-18(28)22-15-7-9-16(10-8-15)30(25,26)23-19-20-11-12-29-19/h3-12H,2H2,1H3,(H,20,23)(H2,21,22,28)