S-[[1-[2-cyclopropyl-1-(2-fluorophenyl)-2-oxidanylidene-ethyl]piperidin-4-yl]methyl] ethanethioate

Systemtic Name: S-[[1-[2-cyclopropyl-1-(2-fluorophenyl)-2-oxidanylidene-ethyl]piperidin-4-yl]methyl] ethanethioate Openeye Name: S-[[1-[2-cyclopropyl-1-(2-fluorophenyl)-2-oxo-ethyl]-4-piperidyl]methyl] ethanethioate CAS Name: ethanethioic acid S-[[1-[2-cyclopropyl-1-(2-fluorophenyl)-2-oxoethyl]-4-piperidinyl]methyl] ester IUPAC Name: S-[[1-[2-cyclopropyl-1-(2-fluorophenyl)-2-oxoethyl]piperidin-4-yl]methyl] ethanethioate Traditional Name: ethanethioic acid S-[[1-[2-cyclopropyl-1-(2-fluorophenyl)-2-keto-ethyl]-4-piperidyl]methyl] ester Formula: C19H24FNO2S MolecularWeight: 349.462763

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCC1CCN(CC1)C(C2=CC=CC=C2F)C(=O)C3CC3

Isomeric SMILES

CC(=O)SCC1CCN(CC1)C(C2=CC=CC=C2F)C(=O)C3CC3

InChI

InChI=1S/C19H24FNO2S/c1-13(22)24-12-14-8-10-21(11-9-14)18(19(23)15-6-7-15)16-4-2-3-5-17(16)20/h2-5,14-15,18H,6-12H2,1H3