N,N-diethyl-2-(pyridin-2-ylsulfanylmethyl)-3H-benzimidazole-5-sulfonamide

Systemtic Name: N,N-diethyl-2-(pyridin-2-ylsulfanylmethyl)-3H-benzimidazole-5-sulfonamide Openeye Name: N,N-diethyl-2-(2-pyridylsulfanylmethyl)-3H-benzimidazole-5-sulfonamide CAS Name: N,N-diethyl-2-[(2-pyridinylthio)methyl]-3H-benzimidazole-5-sulfonamide IUPAC Name: N,N-diethyl-2-(pyridin-2-ylsulfanylmethyl)-3H-benzimidazole-5-sulfonamide Traditional Name: N,N-diethyl-2-[(2-pyridylthio)methyl]-3H-benzimidazole-5-sulfonamide Formula: C17H20N4O2S2 MolecularWeight: 376.4963

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)N=C(N2)CSC3=CC=CC=N3

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)N=C(N2)CSC3=CC=CC=N3

InChI

InChI=1S/C17H20N4O2S2/c1-3-21(4-2)25(22,23)13-8-9-14-15(11-13)20-16(19-14)12-24-17-7-5-6-10-18-17/h5-11H,3-4,12H2,1-2H3,(H,19,20)