1-(4-methylsulfanylphenyl)-5,6-dihydro-4H-cyclopenta[c]pyrazole-3-carboxylate

Systemtic Name: 1-(4-methylsulfanylphenyl)-5,6-dihydro-4H-cyclopenta[c]pyrazole-3-carboxylate Openeye Name: 1-(4-methylsulfanylphenyl)-5,6-dihydro-4H-cyclopenta[c]pyrazole-3-carboxylate CAS Name: 1-[4-(methylthio)phenyl]-5,6-dihydro-4H-cyclopenta[c]pyrazole-3-carboxylate IUPAC Name: 1-(4-methylsulfanylphenyl)-5,6-dihydro-4H-cyclopenta[c]pyrazole-3-carboxylate Traditional Name: 1-[4-(methylthio)phenyl]-5,6-dihydro-4H-cyclopenta[c]pyrazole-3-carboxylate Formula: C14H13N2O2S- MolecularWeight: 273.33022

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)N2C3=C(CCC3)C(=N2)C(=O)[O-]

Isomeric SMILES

CSC1=CC=C(C=C1)N2C3=C(CCC3)C(=N2)C(=O)[O-]

InChI

InChI=1S/C14H14N2O2S/c1-19-10-7-5-9(6-8-10)16-12-4-2-3-11(12)13(15-16)14(17)18/h5-8H,2-4H2,1H3,(H,17,18)/p-1