1-[(3S)-3-[2-(4-methoxyphenyl)ethyl]piperidin-1-yl]-3-methylsulfanyl-propan-1-one

Systemtic Name: 1-[(3S)-3-[2-(4-methoxyphenyl)ethyl]piperidin-1-yl]-3-methylsulfanyl-propan-1-one Openeye Name: 1-[(3S)-3-[2-(4-methoxyphenyl)ethyl]-1-piperidyl]-3-methylsulfanyl-propan-1-one CAS Name: 1-[(3S)-3-[2-(4-methoxyphenyl)ethyl]-1-piperidinyl]-3-(methylthio)-1-propanone IUPAC Name: 1-[(3S)-3-[2-(4-methoxyphenyl)ethyl]piperidin-1-yl]-3-methylsulfanylpropan-1-one Traditional Name: 1-[(3S)-3-[2-(4-methoxyphenyl)ethyl]piperidino]-3-(methylthio)propan-1-one Formula: C18H27NO2S MolecularWeight: 321.47748

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCC2CCCN(C2)C(=O)CCSC

Isomeric SMILES

COC1=CC=C(C=C1)CC[C@H]2CCCN(C2)C(=O)CCSC

InChI

InChI=1S/C18H27NO2S/c1-21-17-9-7-15(8-10-17)5-6-16-4-3-12-19(14-16)18(20)11-13-22-2/h7-10,16H,3-6,11-14H2,1-2H3/t16-/m1/s1