2-[[(2S)-6-fluoranyl-2-phenyl-4H-1,3-benzodioxin-8-yl]methylsulfanyl]-1-[(2S)-2-methylpiperidin-1-yl]ethanone

Systemtic Name: 2-[[(2S)-6-fluoranyl-2-phenyl-4H-1,3-benzodioxin-8-yl]methylsulfanyl]-1-[(2S)-2-methylpiperidin-1-yl]ethanone Openeye Name: 2-[[(2S)-6-fluoro-2-phenyl-4H-1,3-benzodioxin-8-yl]methylsulfanyl]-1-[(2S)-2-methyl-1-piperidyl]ethanone CAS Name: 2-[[(2S)-6-fluoro-2-phenyl-4H-1,3-benzodioxin-8-yl]methylthio]-1-[(2S)-2-methyl-1-piperidinyl]ethanone IUPAC Name: 2-[[(2S)-6-fluoro-2-phenyl-4H-1,3-benzodioxin-8-yl]methylsulfanyl]-1-[(2S)-2-methylpiperidin-1-yl]ethanone Traditional Name: 2-[[(2S)-6-fluoro-2-phenyl-4H-1,3-benzodioxin-8-yl]methylthio]-1-[(2S)-2-methylpiperidino]ethanone Formula: C23H26FNO3S MolecularWeight: 415.520843

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1C(=O)CSCC2=C3C(=CC(=C2)F)COC(O3)C4=CC=CC=C4

Isomeric SMILES

C[C@H]1CCCCN1C(=O)CSCC2=C3C(=CC(=C2)F)CO[C@@H](O3)C4=CC=CC=C4

InChI

InChI=1S/C23H26FNO3S/c1-16-7-5-6-10-25(16)21(26)15-29-14-19-12-20(24)11-18-13-27-23(28-22(18)19)17-8-3-2-4-9-17/h2-4,8-9,11-12,16,23H,5-7,10,13-15H2,1H3/t16-,23-/m0/s1