2-[(4-sulfamoylphenyl)amino]pyridine-3-carbothioamide

Systemtic Name: 2-[(4-sulfamoylphenyl)amino]pyridine-3-carbothioamide Openeye Name: 2-(4-sulfamoylanilino)pyridine-3-carbothioamide CAS Name: 2-(4-sulfamoylanilino)-3-pyridinecarbothioamide IUPAC Name: 2-(4-sulfamoylanilino)pyridine-3-carbothioamide Traditional Name: 2-(4-sulfamoylanilino)thionicotinamide Formula: C12H12N4O2S2 MolecularWeight: 308.37928

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)NC2=CC=C(C=C2)S(=O)(=O)N)C(=S)N

Isomeric SMILES

C1=CC(=C(N=C1)NC2=CC=C(C=C2)S(=O)(=O)N)C(=S)N

InChI

InChI=1S/C12H12N4O2S2/c13-11(19)10-2-1-7-15-12(10)16-8-3-5-9(6-4-8)20(14,17)18/h1-7H,(H2,13,19)(H,15,16)(H2,14,17,18)