6-bromanyl-3-[[1-[2-(4-fluorophenyl)-2-oxidanyl-ethyl]piperidin-4-yl]methyl]-1,3-benzothiazol-2-one

Systemtic Name: 6-bromanyl-3-[[1-[2-(4-fluorophenyl)-2-oxidanyl-ethyl]piperidin-4-yl]methyl]-1,3-benzothiazol-2-one Openeye Name: 6-bromo-3-[[1-[2-(4-fluorophenyl)-2-hydroxy-ethyl]-4-piperidyl]methyl]-1,3-benzothiazol-2-one CAS Name: 6-bromo-3-[[1-[2-(4-fluorophenyl)-2-hydroxyethyl]-4-piperidinyl]methyl]-1,3-benzothiazol-2-one IUPAC Name: 6-bromo-3-[[1-[2-(4-fluorophenyl)-2-hydroxyethyl]piperidin-4-yl]methyl]-1,3-benzothiazol-2-one Traditional Name: 6-bromo-3-[[1-[2-(4-fluorophenyl)-2-hydroxy-ethyl]-4-piperidyl]methyl]-1,3-benzothiazol-2-one Formula: C21H22BrFN2O2S MolecularWeight: 465.378983

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CN2C3=C(C=C(C=C3)Br)SC2=O)CC(C4=CC=C(C=C4)F)O

Isomeric SMILES

C1CN(CCC1CN2C3=C(C=C(C=C3)Br)SC2=O)CC(C4=CC=C(C=C4)F)O

InChI

InChI=1S/C21H22BrFN2O2S/c22-16-3-6-18-20(11-16)28-21(27)25(18)12-14-7-9-24(10-8-14)13-19(26)15-1-4-17(23)5-2-15/h1-6,11,14,19,26H,7-10,12-13H2