N-(4,5-dihydro-1H-imidazol-2-yl)-4-isothiocyanato-benzenesulfonamide

Systemtic Name: N-(4,5-dihydro-1H-imidazol-2-yl)-4-isothiocyanato-benzenesulfonamide Openeye Name: N-(4,5-dihydro-1H-imidazol-2-yl)-4-isothiocyanato-benzenesulfonamide CAS Name: N-(4,5-dihydro-1H-imidazol-2-yl)-4-isothiocyanatobenzenesulfonamide IUPAC Name: N-(4,5-dihydro-1H-imidazol-2-yl)-4-isothiocyanatobenzenesulfonamide Traditional Name: N-(2-imidazolin-2-yl)-4-isothiocyanato-benzenesulfonamide Formula: C10H10N4O2S2 MolecularWeight: 282.342

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN=C(N1)NS(=O)(=O)C2=CC=C(C=C2)N=C=S

Isomeric SMILES

C1CN=C(N1)NS(=O)(=O)C2=CC=C(C=C2)N=C=S

InChI

InChI=1S/C10H10N4O2S2/c15-18(16,14-10-11-5-6-12-10)9-3-1-8(2-4-9)13-7-17/h1-4H,5-6H2,(H2,11,12,14)