ethyl [5-(1-methyl-5-nitro-4,5-dihydroimidazol-2-yl)-1,3,4-thiadiazol-2-yl]sulfinylmethanoate

Systemtic Name: ethyl [5-(1-methyl-5-nitro-4,5-dihydroimidazol-2-yl)-1,3,4-thiadiazol-2-yl]sulfinylmethanoate Openeye Name: ethyl [5-(1-methyl-5-nitro-4,5-dihydroimidazol-2-yl)-1,3,4-thiadiazol-2-yl]sulfinylformate CAS Name: [5-(1-methyl-5-nitro-4,5-dihydroimidazol-2-yl)-1,3,4-thiadiazol-2-yl]sulfinylformic acid ethyl ester IUPAC Name: ethyl [5-(1-methyl-5-nitro-4,5-dihydroimidazol-2-yl)-1,3,4-thiadiazol-2-yl]sulfinylformate Traditional Name: [5-(1-methyl-5-nitro-2-imidazolin-2-yl)-1,3,4-thiadiazol-2-yl]sulfinylformic acid ethyl ester Formula: C9H11N5O5S2 MolecularWeight: 333.34414

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H11N5O5S2/c1-3-19-9(15)21(18)8-12-11-7(20-8)6-10-4-5(13(6)2)14(16)17/h5H,3-4H2,1-2H3