5-nitro-3-[2-phenyl-2-(phenylmethyl)sulfinyl-ethenyl]-1H-benzimidazole-2-thione

Systemtic Name: 5-nitro-3-[2-phenyl-2-(phenylmethyl)sulfinyl-ethenyl]-1H-benzimidazole-2-thione Openeye Name: 3-(2-benzylsulfinyl-2-phenyl-vinyl)-5-nitro-1H-benzimidazole-2-thione CAS Name: 5-nitro-3-[2-phenyl-2-(phenylmethyl)sulfinylethenyl]-1H-benzimidazole-2-thione IUPAC Name: 3-(2-benzylsulfinyl-2-phenylethenyl)-5-nitro-1H-benzimidazole-2-thione Traditional Name: 3-(2-benzylsulfinyl-2-phenyl-vinyl)-5-nitro-1H-benzimidazole-2-thione Formula: C22H17N3O3S2 MolecularWeight: 435.51868

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CS(=O)C(=CN2C3=C(C=CC(=C3)[N+](=O)[O-])NC2=S)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CS(=O)C(=CN2C3=C(C=CC(=C3)[N+](=O)[O-])NC2=S)C4=CC=CC=C4

InChI

InChI=1S/C22H17N3O3S2/c26-25(27)18-11-12-19-20(13-18)24(22(29)23-19)14-21(17-9-5-2-6-10-17)30(28)15-16-7-3-1-4-8-16/h1-14H,15H2,(H,23,29)