[2-[2-[2-(cyclohexen-1-yl)ethylcarbamothioyl]pyrazolidin-1-yl]-2-oxidanylidene-ethyl] ethanoate

Systemtic Name: [2-[2-[2-(cyclohexen-1-yl)ethylcarbamothioyl]pyrazolidin-1-yl]-2-oxidanylidene-ethyl] ethanoate Openeye Name: [2-[2-[2-(cyclohexen-1-yl)ethylcarbamothioyl]pyrazolidin-1-yl]-2-oxo-ethyl] acetate CAS Name: acetic acid [2-[2-[[2-(1-cyclohexenyl)ethylamino]-sulfanylidenemethyl]-1-pyrazolidinyl]-2-oxoethyl] ester IUPAC Name: [2-[2-[2-(cyclohexen-1-yl)ethylcarbamothioyl]pyrazolidin-1-yl]-2-oxoethyl] acetate Traditional Name: acetic acid [2-[2-[2-(cyclohexen-1-yl)ethylthiocarbamoyl]pyrazolidin-1-yl]-2-keto-ethyl] ester Formula: C16H25N3O3S MolecularWeight: 339.453

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC(=O)N1CCCN1C(=S)NCCC2=CCCCC2

Isomeric SMILES

CC(=O)OCC(=O)N1CCCN1C(=S)NCCC2=CCCCC2

InChI

InChI=1S/C16H25N3O3S/c1-13(20)22-12-15(21)18-10-5-11-19(18)16(23)17-9-8-14-6-3-2-4-7-14/h6H,2-5,7-12H2,1H3,(H,17,23)