2-nitro-1-(6-phenylsulfanylhexyl)imidazole

Systemtic Name: 2-nitro-1-(6-phenylsulfanylhexyl)imidazole Openeye Name: 2-nitro-1-(6-phenylsulfanylhexyl)imidazole CAS Name: 2-nitro-1-[6-(phenylthio)hexyl]imidazole IUPAC Name: 2-nitro-1-(6-phenylsulfanylhexyl)imidazole Traditional Name: 2-nitro-1-[6-(phenylthio)hexyl]imidazole Formula: C15H19N3O2S MolecularWeight: 305.39526

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCCCCCCN2C=CN=C2[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)SCCCCCCN2C=CN=C2[N+](=O)[O-]

InChI

InChI=1S/C15H19N3O2S/c19-18(20)15-16-10-12-17(15)11-6-1-2-7-13-21-14-8-4-3-5-9-14/h3-5,8-10,12H,1-2,6-7,11,13H2