2-(2-ethylsulfanylethylsulfanyl)-5-(1-methyl-5-nitro-imidazol-2-yl)-1,3,4-thiadiazole

Systemtic Name: 2-(2-ethylsulfanylethylsulfanyl)-5-(1-methyl-5-nitro-imidazol-2-yl)-1,3,4-thiadiazole Openeye Name: 2-(2-ethylsulfanylethylsulfanyl)-5-(1-methyl-5-nitro-imidazol-2-yl)-1,3,4-thiadiazole CAS Name: 2-[2-(ethylthio)ethylthio]-5-(1-methyl-5-nitro-2-imidazolyl)-1,3,4-thiadiazole IUPAC Name: 2-(2-ethylsulfanylethylsulfanyl)-5-(1-methyl-5-nitroimidazol-2-yl)-1,3,4-thiadiazole Traditional Name: 2-[2-(ethylthio)ethylthio]-5-(1-methyl-5-nitro-imidazol-2-yl)-1,3,4-thiadiazole Formula: C10H13N5O2S3 MolecularWeight: 331.43752

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Descriptors Computed from Structure

Canonical SMILES:

CCSCCSC1=NN=C(S1)C2=NC=C(N2C)[N+](=O)[O-]

Isomeric SMILES

CCSCCSC1=NN=C(S1)C2=NC=C(N2C)[N+](=O)[O-]

InChI

InChI=1S/C10H13N5O2S3/c1-3-18-4-5-19-10-13-12-9(20-10)8-11-6-7(14(8)2)15(16)17/h6H,3-5H2,1-2H3