4-(2-morpholin-4-ium-4-ylethyl)-1-[(5-nitrothiophen-2-yl)methylidene]imidazo[1,2-a]benzimidazol-2-one

Systemtic Name: 4-(2-morpholin-4-ium-4-ylethyl)-1-[(5-nitrothiophen-2-yl)methylidene]imidazo[1,2-a]benzimidazol-2-one Openeye Name: 4-(2-morpholin-4-ium-4-ylethyl)-1-[(5-nitro-2-thienyl)methylene]imidazo[1,2-a]benzimidazol-2-one CAS Name: 4-[2-(4-morpholin-4-iumyl)ethyl]-1-[(5-nitro-2-thiophenyl)methylidene]-2-imidazo[1,2-a]benzimidazolone IUPAC Name: 4-(2-morpholin-4-ium-4-ylethyl)-1-[(5-nitrothiophen-2-yl)methylidene]imidazo[1,2-a]benzimidazol-2-one Traditional Name: 4-(2-morpholin-4-ium-4-ylethyl)-1-[(5-nitro-2-thienyl)methylene]imidazo[1,2-a]benzimidazol-2-one Formula: C20H20N5O4S+ MolecularWeight: 426.4689

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCN2C3=CC=CC=C3N4C2=NC(=O)C4=CC5=CC=C(S5)[N+](=O)[O-]

Isomeric SMILES

C1COCC[NH+]1CCN2C3=CC=CC=C3N4C2=NC(=O)C4=CC5=CC=C(S5)[N+](=O)[O-]

InChI

InChI=1S/C20H19N5O4S/c26-19-17(13-14-5-6-18(30-14)25(27)28)24-16-4-2-1-3-15(16)23(20(24)21-19)8-7-22-9-11-29-12-10-22/h1-6,13H,7-12H2/p+1