(1-methyl-5-nitro-imidazol-2-yl)methylsulfanyl-phenylmethoxysulfanyl-methanone

Systemtic Name: (1-methyl-5-nitro-imidazol-2-yl)methylsulfanyl-phenylmethoxysulfanyl-methanone Openeye Name: benzyloxysulfanyl-[(1-methyl-5-nitro-imidazol-2-yl)methylsulfanyl]methanone CAS Name: [(1-methyl-5-nitro-2-imidazolyl)methylthio]-oxomethanesulfenic acid (phenylmethyl) ester IUPAC Name: (1-methyl-5-nitroimidazol-2-yl)methylsulfanyl-phenylmethoxysulfanylmethanone Traditional Name: (benzoxythio)-[(1-methyl-5-nitro-imidazol-2-yl)methylthio]methanone Formula: C13H13N3O4S2 MolecularWeight: 339.39002

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CN=C1CSC(=O)SOCC2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CN1C(=CN=C1CSC(=O)SOCC2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H13N3O4S2/c1-15-11(14-7-12(15)16(18)19)9-21-13(17)22-20-8-10-5-3-2-4-6-10/h2-7H,8-9H2,1H3