2-cyano-2-[4-[4-(dimethylsulfamoyl)phenyl]-1,3-thiazol-2-yl]ethanedithioic acid

Systemtic Name: 2-cyano-2-[4-[4-(dimethylsulfamoyl)phenyl]-1,3-thiazol-2-yl]ethanedithioic acid Openeye Name: 2-cyano-2-[4-[4-(dimethylsulfamoyl)phenyl]thiazol-2-yl]ethanedithioic acid CAS Name: 2-cyano-2-[4-[4-(dimethylsulfamoyl)phenyl]-2-thiazolyl]ethanedithioic acid IUPAC Name: 2-cyano-2-[4-[4-(dimethylsulfamoyl)phenyl]-1,3-thiazol-2-yl]ethanedithioic acid Traditional Name: 2-cyano-2-[4-[4-(dimethylsulfamoyl)phenyl]thiazol-2-yl]ethanedithioic acid Formula: C14H13N3O2S4 MolecularWeight: 383.53192

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=C(C=C1)C2=CSC(=N2)C(C#N)C(=S)S

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=C(C=C1)C2=CSC(=N2)C(C#N)C(=S)S

InChI

InChI=1S/C14H13N3O2S4/c1-17(2)23(18,19)10-5-3-9(4-6-10)12-8-22-13(16-12)11(7-15)14(20)21/h3-6,8,11H,1-2H3,(H,20,21)