ethyl 2-(2,5-dimethyl-4-nitro-pyrazol-3-yl)sulfanylethanoate

Systemtic Name: ethyl 2-(2,5-dimethyl-4-nitro-pyrazol-3-yl)sulfanylethanoate Openeye Name: ethyl 2-(2,5-dimethyl-4-nitro-pyrazol-3-yl)sulfanylacetate CAS Name: 2-[(2,5-dimethyl-4-nitro-3-pyrazolyl)thio]acetic acid ethyl ester IUPAC Name: ethyl 2-(2,5-dimethyl-4-nitropyrazol-3-yl)sulfanylacetate Traditional Name: 2-[(2,5-dimethyl-4-nitro-pyrazol-3-yl)thio]acetic acid ethyl ester Formula: C9H13N3O4S MolecularWeight: 259.28222

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=C(C(=NN1C)C)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)CSC1=C(C(=NN1C)C)[N+](=O)[O-]

InChI

InChI=1S/C9H13N3O4S/c1-4-16-7(13)5-17-9-8(12(14)15)6(2)10-11(9)3/h4-5H2,1-3H3