3-azanyl-N-(3-imidazol-1-ylpropyl)benzenesulfonamide

Systemtic Name: 3-azanyl-N-(3-imidazol-1-ylpropyl)benzenesulfonamide Openeye Name: 3-amino-N-(3-imidazol-1-ylpropyl)benzenesulfonamide CAS Name: 3-amino-N-[3-(1-imidazolyl)propyl]benzenesulfonamide IUPAC Name: 3-amino-N-(3-imidazol-1-ylpropyl)benzenesulfonamide Traditional Name: 3-amino-N-(3-imidazol-1-ylpropyl)benzenesulfonamide Formula: C12H16N4O2S MolecularWeight: 280.34604

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16N4O2S/c13-11-3-1-4-12(9-11)19(17,18)15-5-2-7-16-8-6-14-10-16/h1,3-4,6,8-10,15H,2,5,7,13H2