2-[4-(1,3-benzothiazol-2-ylmethyl)-1-[(2-fluoranyl-4-methoxy-phenyl)methyl]piperazin-2-yl]ethanol

Systemtic Name: 2-[4-(1,3-benzothiazol-2-ylmethyl)-1-[(2-fluoranyl-4-methoxy-phenyl)methyl]piperazin-2-yl]ethanol Openeye Name: 2-[4-(1,3-benzothiazol-2-ylmethyl)-1-[(2-fluoro-4-methoxy-phenyl)methyl]piperazin-2-yl]ethanol CAS Name: 2-[4-(1,3-benzothiazol-2-ylmethyl)-1-[(2-fluoro-4-methoxyphenyl)methyl]-2-piperazinyl]ethanol IUPAC Name: 2-[4-(1,3-benzothiazol-2-ylmethyl)-1-[(2-fluoro-4-methoxyphenyl)methyl]piperazin-2-yl]ethanol Traditional Name: 2-[4-(1,3-benzothiazol-2-ylmethyl)-1-(2-fluoro-4-methoxy-benzyl)piperazin-2-yl]ethanol Formula: C22H26FN3O2S MolecularWeight: 415.524143

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)CN2CCN(CC2CCO)CC3=NC4=CC=CC=C4S3)F

Isomeric SMILES

COC1=CC(=C(C=C1)CN2CCN(CC2CCO)CC3=NC4=CC=CC=C4S3)F

InChI

InChI=1S/C22H26FN3O2S/c1-28-18-7-6-16(19(23)12-18)13-26-10-9-25(14-17(26)8-11-27)15-22-24-20-4-2-3-5-21(20)29-22/h2-7,12,17,27H,8-11,13-15H2,1H3