N-[[3-(phenylsulfonylaminomethyl)-2-sulfanylidene-benzimidazol-1-yl]methyl]benzenesulfonamide

Systemtic Name: N-[[3-(phenylsulfonylaminomethyl)-2-sulfanylidene-benzimidazol-1-yl]methyl]benzenesulfonamide Openeye Name: N-[[3-(benzenesulfonamidomethyl)-2-thioxo-benzimidazol-1-yl]methyl]benzenesulfonamide CAS Name: N-[[3-(benzenesulfonamidomethyl)-2-sulfanylidene-1-benzimidazolyl]methyl]benzenesulfonamide IUPAC Name: N-[[3-(benzenesulfonamidomethyl)-2-sulfanylidenebenzimidazol-1-yl]methyl]benzenesulfonamide Traditional Name: N-[[3-(benzenesulfonamidomethyl)-2-thioxo-benzimidazol-1-yl]methyl]benzenesulfonamide Formula: C21H20N4O4S3 MolecularWeight: 488.6029

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)NCN2C3=CC=CC=C3N(C2=S)CNS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)NCN2C3=CC=CC=C3N(C2=S)CNS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H20N4O4S3/c26-31(27,17-9-3-1-4-10-17)22-15-24-19-13-7-8-14-20(19)25(21(24)30)16-23-32(28,29)18-11-5-2-6-12-18/h1-14,22-23H,15-16H2