[(3S)-1-[(2-fluoranyl-4-methoxy-phenyl)methyl]piperidin-3-yl]-(2-methylsulfanylphenyl)methanone

Systemtic Name: [(3S)-1-[(2-fluoranyl-4-methoxy-phenyl)methyl]piperidin-3-yl]-(2-methylsulfanylphenyl)methanone Openeye Name: [(3S)-1-[(2-fluoro-4-methoxy-phenyl)methyl]-3-piperidyl]-(2-methylsulfanylphenyl)methanone CAS Name: [(3S)-1-[(2-fluoro-4-methoxyphenyl)methyl]-3-piperidinyl]-[2-(methylthio)phenyl]methanone IUPAC Name: [(3S)-1-[(2-fluoro-4-methoxyphenyl)methyl]piperidin-3-yl]-(2-methylsulfanylphenyl)methanone Traditional Name: [(3S)-1-(2-fluoro-4-methoxy-benzyl)-3-piperidyl]-[2-(methylthio)phenyl]methanone Formula: C21H24FNO2S MolecularWeight: 373.484163

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)CN2CCCC(C2)C(=O)C3=CC=CC=C3SC)F

Isomeric SMILES

COC1=CC(=C(C=C1)CN2CCC[C@@H](C2)C(=O)C3=CC=CC=C3SC)F

InChI

InChI=1S/C21H24FNO2S/c1-25-17-10-9-15(19(22)12-17)13-23-11-5-6-16(14-23)21(24)18-7-3-4-8-20(18)26-2/h3-4,7-10,12,16H,5-6,11,13-14H2,1-2H3/t16-/m0/s1