methyl 2-[(5-methyl-4-nitro-1H-pyrazol-3-yl)sulfanyl]ethanoate

Systemtic Name: methyl 2-[(5-methyl-4-nitro-1H-pyrazol-3-yl)sulfanyl]ethanoate Openeye Name: methyl 2-[(5-methyl-4-nitro-1H-pyrazol-3-yl)sulfanyl]acetate CAS Name: 2-[(5-methyl-4-nitro-1H-pyrazol-3-yl)thio]acetic acid methyl ester IUPAC Name: methyl 2-[(5-methyl-4-nitro-1H-pyrazol-3-yl)sulfanyl]acetate Traditional Name: 2-[(5-methyl-4-nitro-1H-pyrazol-3-yl)thio]acetic acid methyl ester Formula: C7H9N3O4S MolecularWeight: 231.22906

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)SCC(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1)SCC(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C7H9N3O4S/c1-4-6(10(12)13)7(9-8-4)15-3-5(11)14-2/h3H2,1-2H3,(H,8,9)