2-[(4-nitro-1H-benzimidazol-2-yl)sulfanyl]-1-phenyl-ethanone

Systemtic Name: 2-[(4-nitro-1H-benzimidazol-2-yl)sulfanyl]-1-phenyl-ethanone Openeye Name: 2-[(4-nitro-1H-benzimidazol-2-yl)sulfanyl]-1-phenyl-ethanone CAS Name: 2-[(4-nitro-1H-benzimidazol-2-yl)thio]-1-phenylethanone IUPAC Name: 2-[(4-nitro-1H-benzimidazol-2-yl)sulfanyl]-1-phenylethanone Traditional Name: 2-[(4-nitro-1H-benzimidazol-2-yl)thio]-1-phenyl-ethanone Formula: C15H11N3O3S MolecularWeight: 313.33114

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)CSC2=NC3=C(N2)C=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)CSC2=NC3=C(N2)C=CC=C3[N+](=O)[O-]

InChI

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