(NE)-3-cyano-5-iodanyl-N-[(4-methylpiperazin-1-yl)methylidene]benzenesulfonamide

Systemtic Name: (NE)-3-cyano-5-iodanyl-N-[(4-methylpiperazin-1-yl)methylidene]benzenesulfonamide Openeye Name: (NE)-3-cyano-5-iodo-N-[(4-methylpiperazin-1-yl)methylene]benzenesulfonamide CAS Name: (NE)-3-cyano-5-iodo-N-[(4-methyl-1-piperazinyl)methylidene]benzenesulfonamide IUPAC Name: (NE)-3-cyano-5-iodo-N-[(4-methylpiperazin-1-yl)methylidene]benzenesulfonamide Traditional Name: (NE)-3-cyano-5-iodo-N-[(4-methylpiperazino)methylene]benzenesulfonamide Formula: C13H15IN4O2S MolecularWeight: 418.25327

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C=NS(=O)(=O)C2=CC(=CC(=C2)C#N)I

Isomeric SMILES

CN1CCN(CC1)/C=N/S(=O)(=O)C2=CC(=CC(=C2)C#N)I

InChI

InChI=1S/C13H15IN4O2S/c1-17-2-4-18(5-3-17)10-16-21(19,20)13-7-11(9-15)6-12(14)8-13/h6-8,10H,2-5H2,1H3/b16-10+