dimethyl-[5-[(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)carbamoyl]-3-phenyl-1H-thieno[2,3-d]imidazol-2-ylidene]azanium

Systemtic Name: dimethyl-[5-[(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)carbamoyl]-3-phenyl-1H-thieno[2,3-d]imidazol-2-ylidene]azanium Openeye Name: dimethyl-[5-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)carbamoyl]-3-phenyl-1H-thieno[2,3-d]imidazol-2-ylidene]ammonium CAS Name: dimethyl-[5-[oxo-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)amino]methyl]-3-phenyl-1H-thieno[2,3-d]imidazol-2-ylidene]ammonium IUPAC Name: dimethyl-[5-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)carbamoyl]-3-phenyl-1H-thieno[2,3-d]imidazol-2-ylidene]azanium Traditional Name: [5-[(2-keto-1,3-dihydrobenzimidazol-5-yl)carbamoyl]-3-phenyl-1H-thien[2,3-d]imidazol-2-ylidene]-dimethyl-ammonium Formula: C21H19N6O2S+ MolecularWeight: 419.47956

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](=C1NC2=C(N1C3=CC=CC=C3)SC(=C2)C(=O)NC4=CC5=C(C=C4)NC(=O)N5)C

Isomeric SMILES

C[N+](=C1NC2=C(N1C3=CC=CC=C3)SC(=C2)C(=O)NC4=CC5=C(C=C4)NC(=O)N5)C

InChI

InChI=1S/C21H18N6O2S/c1-26(2)21-25-16-11-17(30-19(16)27(21)13-6-4-3-5-7-13)18(28)22-12-8-9-14-15(10-12)24-20(29)23-14/h3-11H,1-2H3,(H3,22,23,24,28,29)/p+1