2-tert-butyl-4-ethylsulfanyl-pyrazole-3-carboxylate

Systemtic Name: 2-tert-butyl-4-ethylsulfanyl-pyrazole-3-carboxylate Openeye Name: 2-tert-butyl-4-ethylsulfanyl-pyrazole-3-carboxylate CAS Name: 2-tert-butyl-4-(ethylthio)-3-pyrazolecarboxylate IUPAC Name: 2-tert-butyl-4-ethylsulfanylpyrazole-3-carboxylate Traditional Name: 2-tert-butyl-4-(ethylthio)pyrazole-3-carboxylate Formula: C10H15N2O2S- MolecularWeight: 227.3033

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=C(N(N=C1)C(C)(C)C)C(=O)[O-]

Isomeric SMILES

CCSC1=C(N(N=C1)C(C)(C)C)C(=O)[O-]

InChI

InChI=1S/C10H16N2O2S/c1-5-15-7-6-11-12(10(2,3)4)8(7)9(13)14/h6H,5H2,1-4H3,(H,13,14)/p-1