methyl 4-azanyl-2-sulfanylidene-3-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]-1,3-thiazole-5-carboxylate

Systemtic Name: methyl 4-azanyl-2-sulfanylidene-3-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]-1,3-thiazole-5-carboxylate Openeye Name: methyl 4-amino-3-[4-(thiazol-2-ylsulfamoyl)phenyl]-2-thioxo-thiazole-5-carboxylate CAS Name: 4-amino-2-sulfanylidene-3-[4-(2-thiazolylsulfamoyl)phenyl]-5-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 4-amino-2-sulfanylidene-3-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]-1,3-thiazole-5-carboxylate Traditional Name: 4-amino-3-[4-(thiazol-2-ylsulfamoyl)phenyl]-2-thioxo-4-thiazoline-5-carboxylic acid methyl ester Formula: C14H12N4O4S4 MolecularWeight: 428.52948

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(N(C(=S)S1)C2=CC=C(C=C2)S(=O)(=O)NC3=NC=CS3)N

Isomeric SMILES

COC(=O)C1=C(N(C(=S)S1)C2=CC=C(C=C2)S(=O)(=O)NC3=NC=CS3)N

InChI

InChI=1S/C14H12N4O4S4/c1-22-12(19)10-11(15)18(14(23)25-10)8-2-4-9(5-3-8)26(20,21)17-13-16-6-7-24-13/h2-7H,15H2,1H3,(H,16,17)