N,N,1-triethyl-2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)methylsulfanyl]benzimidazole-5-sulfonamide

Systemtic Name: N,N,1-triethyl-2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)methylsulfanyl]benzimidazole-5-sulfonamide Openeye Name: N,N,1-triethyl-2-[(1-phenyltetrazol-5-yl)methylsulfanyl]benzimidazole-5-sulfonamide CAS Name: N,N,1-triethyl-2-[(1-phenyl-5-tetrazolyl)methylthio]-5-benzimidazolesulfonamide IUPAC Name: N,N,1-triethyl-2-[(1-phenyltetrazol-5-yl)methylsulfanyl]benzimidazole-5-sulfonamide Traditional Name: N,N,1-triethyl-2-[(1-phenyltetrazol-5-yl)methylthio]benzimidazole-5-sulfonamide Formula: C21H25N7O2S2 MolecularWeight: 471.5989

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N(CC)CC)N=C1SCC3=NN=NN3C4=CC=CC=C4

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N(CC)CC)N=C1SCC3=NN=NN3C4=CC=CC=C4

InChI

InChI=1S/C21H25N7O2S2/c1-4-26(5-2)32(29,30)17-12-13-19-18(14-17)22-21(27(19)6-3)31-15-20-23-24-25-28(20)16-10-8-7-9-11-16/h7-14H,4-6,15H2,1-3H3