4-(pyridin-2-ylmethylsulfamoyl)benzenecarbothioamide

Systemtic Name: 4-(pyridin-2-ylmethylsulfamoyl)benzenecarbothioamide Openeye Name: 4-(2-pyridylmethylsulfamoyl)benzenecarbothioamide CAS Name: 4-(2-pyridinylmethylsulfamoyl)benzenecarbothioamide IUPAC Name: 4-(pyridin-2-ylmethylsulfamoyl)benzenecarbothioamide Traditional Name: 4-(2-pyridylmethylsulfamoyl)thiobenzamide Formula: C13H13N3O2S2 MolecularWeight: 307.39122

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)CNS(=O)(=O)C2=CC=C(C=C2)C(=S)N

Isomeric SMILES

C1=CC=NC(=C1)CNS(=O)(=O)C2=CC=C(C=C2)C(=S)N

InChI

InChI=1S/C13H13N3O2S2/c14-13(19)10-4-6-12(7-5-10)20(17,18)16-9-11-3-1-2-8-15-11/h1-8,16H,9H2,(H2,14,19)