3-(4-methoxyphenyl)-1-[(3R)-3-(2-methylsulfanylphenyl)carbonylpiperidin-1-yl]propan-1-one

Systemtic Name: 3-(4-methoxyphenyl)-1-[(3R)-3-(2-methylsulfanylphenyl)carbonylpiperidin-1-yl]propan-1-one Openeye Name: 3-(4-methoxyphenyl)-1-[(3R)-3-(2-methylsulfanylbenzoyl)-1-piperidyl]propan-1-one CAS Name: 3-(4-methoxyphenyl)-1-[(3R)-3-[[2-(methylthio)phenyl]-oxomethyl]-1-piperidinyl]-1-propanone IUPAC Name: 3-(4-methoxyphenyl)-1-[(3R)-3-(2-methylsulfanylbenzoyl)piperidin-1-yl]propan-1-one Traditional Name: 3-(4-methoxyphenyl)-1-[(3R)-3-[2-(methylthio)benzoyl]piperidino]propan-1-one Formula: C23H27NO3S MolecularWeight: 397.53038

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCC(=O)N2CCCC(C2)C(=O)C3=CC=CC=C3SC

Isomeric SMILES

COC1=CC=C(C=C1)CCC(=O)N2CCC[C@H](C2)C(=O)C3=CC=CC=C3SC

InChI

InChI=1S/C23H27NO3S/c1-27-19-12-9-17(10-13-19)11-14-22(25)24-15-5-6-18(16-24)23(26)20-7-3-4-8-21(20)28-2/h3-4,7-10,12-13,18H,5-6,11,14-16H2,1-2H3/t18-/m1/s1