3-(3-imidazol-1-ylpropylsulfamoyl)benzenecarbothioamide

Systemtic Name: 3-(3-imidazol-1-ylpropylsulfamoyl)benzenecarbothioamide Openeye Name: 3-(3-imidazol-1-ylpropylsulfamoyl)benzenecarbothioamide CAS Name: 3-[3-(1-imidazolyl)propylsulfamoyl]benzenecarbothioamide IUPAC Name: 3-(3-imidazol-1-ylpropylsulfamoyl)benzenecarbothioamide Traditional Name: 3-(3-imidazol-1-ylpropylsulfamoyl)thiobenzamide Formula: C13H16N4O2S2 MolecularWeight: 324.42174

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)S(=O)(=O)NCCCN2C=CN=C2)C(=S)N

Isomeric SMILES

C1=CC(=CC(=C1)S(=O)(=O)NCCCN2C=CN=C2)C(=S)N

InChI

InChI=1S/C13H16N4O2S2/c14-13(20)11-3-1-4-12(9-11)21(18,19)16-5-2-7-17-8-6-15-10-17/h1,3-4,6,8-10,16H,2,5,7H2,(H2,14,20)