[5-(1-ethyl-3-methyl-5-methylsulfanyl-pyrazol-4-yl)-3-oxidanylidene-cyclohexen-1-yl] cyclopropanecarboxylate

Systemtic Name: [5-(1-ethyl-3-methyl-5-methylsulfanyl-pyrazol-4-yl)-3-oxidanylidene-cyclohexen-1-yl] cyclopropanecarboxylate Openeye Name: [5-(1-ethyl-3-methyl-5-methylsulfanyl-pyrazol-4-yl)-3-oxo-cyclohexen-1-yl] cyclopropanecarboxylate CAS Name: cyclopropanecarboxylic acid [5-[1-ethyl-3-methyl-5-(methylthio)-4-pyrazolyl]-3-oxo-1-cyclohexenyl] ester IUPAC Name: [5-(1-ethyl-3-methyl-5-methylsulfanylpyrazol-4-yl)-3-oxocyclohexen-1-yl] cyclopropanecarboxylate Traditional Name: cyclopropanecarboxylic acid [5-[1-ethyl-3-methyl-5-(methylthio)pyrazol-4-yl]-3-keto-cyclohexen-1-yl] ester Formula: C17H22N2O3S MolecularWeight: 334.43318

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=N1)C)C2CC(=CC(=O)C2)OC(=O)C3CC3)SC

Isomeric SMILES

CCN1C(=C(C(=N1)C)C2CC(=CC(=O)C2)OC(=O)C3CC3)SC

InChI

InChI=1S/C17H22N2O3S/c1-4-19-16(23-3)15(10(2)18-19)12-7-13(20)9-14(8-12)22-17(21)11-5-6-11/h9,11-12H,4-8H2,1-3H3