2-(1H-benzimidazol-2-ylsulfanyl)-1-(4-nitrophenyl)ethanone

Systemtic Name: 2-(1H-benzimidazol-2-ylsulfanyl)-1-(4-nitrophenyl)ethanone Openeye Name: 2-(1H-benzimidazol-2-ylsulfanyl)-1-(4-nitrophenyl)ethanone CAS Name: 2-(1H-benzimidazol-2-ylthio)-1-(4-nitrophenyl)ethanone IUPAC Name: 2-(1H-benzimidazol-2-ylsulfanyl)-1-(4-nitrophenyl)ethanone Traditional Name: 2-(1H-benzimidazol-2-ylthio)-1-(4-nitrophenyl)ethanone Formula: C15H11N3O3S MolecularWeight: 313.33114

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)SCC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)SCC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H11N3O3S/c19-14(10-5-7-11(8-6-10)18(20)21)9-22-15-16-12-3-1-2-4-13(12)17-15/h1-8H,9H2,(H,16,17)