4-[[1-methyl-5-[(phenylmethyl)sulfonylamino]benzimidazol-2-yl]methyl]benzenecarboximidamide

Systemtic Name: 4-[[1-methyl-5-[(phenylmethyl)sulfonylamino]benzimidazol-2-yl]methyl]benzenecarboximidamide Openeye Name: 4-[[5-(benzylsulfonylamino)-1-methyl-benzimidazol-2-yl]methyl]benzamidine CAS Name: 4-[[1-methyl-5-[(phenylmethyl)sulfonylamino]-2-benzimidazolyl]methyl]benzenecarboximidamide IUPAC Name: 4-[[5-(benzylsulfonylamino)-1-methylbenzimidazol-2-yl]methyl]benzenecarboximidamide Traditional Name: 4-[[5-(benzylsulfonylamino)-1-methyl-benzimidazol-2-yl]methyl]benzamidine Formula: C23H23N5O2S MolecularWeight: 433.52602

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)NS(=O)(=O)CC3=CC=CC=C3)N=C1CC4=CC=C(C=C4)C(=N)N

Isomeric SMILES

CN1C2=C(C=C(C=C2)NS(=O)(=O)CC3=CC=CC=C3)N=C1CC4=CC=C(C=C4)C(=N)N

InChI

InChI=1S/C23H23N5O2S/c1-28-21-12-11-19(27-31(29,30)15-17-5-3-2-4-6-17)14-20(21)26-22(28)13-16-7-9-18(10-8-16)23(24)25/h2-12,14,27H,13,15H2,1H3,(H3,24,25)