2-methyl-5-[1-(1-methyl-5-nitro-imidazol-2-yl)-2-sulfonyl-ethyl]-1,3,4-thiadiazole

Systemtic Name: 2-methyl-5-[1-(1-methyl-5-nitro-imidazol-2-yl)-2-sulfonyl-ethyl]-1,3,4-thiadiazole Openeye Name: 2-methyl-5-[1-(1-methyl-5-nitro-imidazol-2-yl)-2-sulfonyl-ethyl]-1,3,4-thiadiazole CAS Name: 2-methyl-5-[1-(1-methyl-5-nitro-2-imidazolyl)-2-sulfonylethyl]-1,3,4-thiadiazole IUPAC Name: 2-methyl-5-[1-(1-methyl-5-nitroimidazol-2-yl)-2-sulfonylethyl]-1,3,4-thiadiazole Traditional Name: 2-methyl-5-[1-(1-methyl-5-nitro-imidazol-2-yl)-2-sulfonyl-ethyl]-1,3,4-thiadiazole Formula: C9H9N5O4S2 MolecularWeight: 315.32886

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(S1)C(C=S(=O)=O)C2=NC=C(N2C)[N+](=O)[O-]

Isomeric SMILES

CC1=NN=C(S1)C(C=S(=O)=O)C2=NC=C(N2C)[N+](=O)[O-]

InChI

InChI=1S/C9H9N5O4S2/c1-5-11-12-9(19-5)6(4-20(17)18)8-10-3-7(13(8)2)14(15)16/h3-4,6H,1-2H3