(5R)-2-butanoyl-5-[(2R)-2-ethylsulfanylpropyl]-3-piperidin-1-yl-cyclohex-2-en-1-one

Systemtic Name: (5R)-2-butanoyl-5-[(2R)-2-ethylsulfanylpropyl]-3-piperidin-1-yl-cyclohex-2-en-1-one Openeye Name: (5R)-2-butanoyl-5-[(2R)-2-ethylsulfanylpropyl]-3-(1-piperidyl)cyclohex-2-en-1-one CAS Name: (5R)-5-[(2R)-2-(ethylthio)propyl]-2-(1-oxobutyl)-3-(1-piperidinyl)-1-cyclohex-2-enone IUPAC Name: (5R)-2-butanoyl-5-[(2R)-2-ethylsulfanylpropyl]-3-piperidin-1-ylcyclohex-2-en-1-one Traditional Name: (5R)-2-butyryl-5-[(2R)-2-(ethylthio)propyl]-3-piperidino-cyclohex-2-en-1-one Formula: C20H33NO2S MolecularWeight: 351.54652

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=C(CC(CC1=O)CC(C)SCC)N2CCCCC2

Isomeric SMILES

CCCC(=O)C1=C(C[C@H](CC1=O)C[C@@H](C)SCC)N2CCCCC2

InChI

InChI=1S/C20H33NO2S/c1-4-9-18(22)20-17(21-10-7-6-8-11-21)13-16(14-19(20)23)12-15(3)24-5-2/h15-16H,4-14H2,1-3H3/t15-,16-/m1/s1