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

Systemtic Name: ethyl 2-[[5-(1-methyl-5-nitro-imidazol-2-yl)-1,3,4-thiadiazol-2-yl]sulfonyl]ethanoate Openeye Name: ethyl 2-[[5-(1-methyl-5-nitro-imidazol-2-yl)-1,3,4-thiadiazol-2-yl]sulfonyl]acetate CAS Name: 2-[[5-(1-methyl-5-nitro-2-imidazolyl)-1,3,4-thiadiazol-2-yl]sulfonyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[[5-(1-methyl-5-nitroimidazol-2-yl)-1,3,4-thiadiazol-2-yl]sulfonyl]acetate Traditional Name: 2-[[5-(1-methyl-5-nitro-imidazol-2-yl)-1,3,4-thiadiazol-2-yl]sulfonyl]acetic acid ethyl ester Formula: C10H11N5O6S2 MolecularWeight: 361.35424

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CS(=O)(=O)C1=NN=C(S1)C2=NC=C(N2C)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)CS(=O)(=O)C1=NN=C(S1)C2=NC=C(N2C)[N+](=O)[O-]

InChI

InChI=1S/C10H11N5O6S2/c1-3-21-7(16)5-23(19,20)10-13-12-9(22-10)8-11-4-6(14(8)2)15(17)18/h4H,3,5H2,1-2H3