(2-nitrophenyl)-[3-(2-nitrophenyl)carbonyl-2-sulfanylidene-benzimidazol-1-yl]methanone

Systemtic Name: (2-nitrophenyl)-[3-(2-nitrophenyl)carbonyl-2-sulfanylidene-benzimidazol-1-yl]methanone Openeye Name: [3-(2-nitrobenzoyl)-2-thioxo-benzimidazol-1-yl]-(2-nitrophenyl)methanone CAS Name: (2-nitrophenyl)-[3-[(2-nitrophenyl)-oxomethyl]-2-sulfanylidene-1-benzimidazolyl]methanone IUPAC Name: [3-(2-nitrobenzoyl)-2-sulfanylidenebenzimidazol-1-yl]-(2-nitrophenyl)methanone Traditional Name: [3-(2-nitrobenzoyl)-2-thioxo-benzimidazol-1-yl]-(2-nitrophenyl)methanone Formula: C21H12N4O6S MolecularWeight: 448.40818

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)N2C3=CC=CC=C3N(C2=S)C(=O)C4=CC=CC=C4[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)N2C3=CC=CC=C3N(C2=S)C(=O)C4=CC=CC=C4[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C21H12N4O6S/c26-19(13-7-1-3-9-15(13)24(28)29)22-17-11-5-6-12-18(17)23(21(22)32)20(27)14-8-2-4-10-16(14)25(30)31/h1-12H