2-[(3-ethyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]-N-[3-(2-nitrophenyl)prop-2-enylideneamino]ethanamide

Systemtic Name: 2-[(3-ethyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]-N-[3-(2-nitrophenyl)prop-2-enylideneamino]ethanamide Openeye Name: 2-[(3-ethyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]-N-[3-(2-nitrophenyl)prop-2-enylideneamino]acetamide CAS Name: 2-[(3-ethyl-1H-benzimidazol-3-ium-2-yl)thio]-N-[3-(2-nitrophenyl)prop-2-enylideneamino]acetamide IUPAC Name: 2-[(3-ethyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]-N-[3-(2-nitrophenyl)prop-2-enylideneamino]acetamide Traditional Name: 2-[(3-ethyl-1H-benzimidazol-3-ium-2-yl)thio]-N-[3-(2-nitrophenyl)prop-2-enylideneamino]acetamide Formula: C20H20N5O3S+ MolecularWeight: 410.4695

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=C(NC2=CC=CC=C21)SCC(=O)NN=CC=CC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC[N+]1=C(NC2=CC=CC=C21)SCC(=O)NN=CC=CC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C20H19N5O3S/c1-2-24-18-12-6-4-10-16(18)22-20(24)29-14-19(26)23-21-13-7-9-15-8-3-5-11-17(15)25(27)28/h3-13H,2,14H2,1H3,(H,23,26)/p+1