N-[[1-[3-(4-fluoranyl-2-phenylmethoxy-phenoxy)propyl]piperidin-4-yl]methyl]-1,3-benzothiazol-2-amine

Systemtic Name: N-[[1-[3-(4-fluoranyl-2-phenylmethoxy-phenoxy)propyl]piperidin-4-yl]methyl]-1,3-benzothiazol-2-amine Openeye Name: N-[[1-[3-(2-benzyloxy-4-fluoro-phenoxy)propyl]-4-piperidyl]methyl]-1,3-benzothiazol-2-amine CAS Name: N-[[1-[3-(4-fluoro-2-phenylmethoxyphenoxy)propyl]-4-piperidinyl]methyl]-1,3-benzothiazol-2-amine IUPAC Name: N-[[1-[3-(4-fluoro-2-phenylmethoxyphenoxy)propyl]piperidin-4-yl]methyl]-1,3-benzothiazol-2-amine Traditional Name: 1,3-benzothiazol-2-yl-[[1-[3-(2-benzoxy-4-fluoro-phenoxy)propyl]-4-piperidyl]methyl]amine Formula: C29H32FN3O2S MolecularWeight: 505.646683

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CNC2=NC3=CC=CC=C3S2)CCCOC4=C(C=C(C=C4)F)OCC5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1CNC2=NC3=CC=CC=C3S2)CCCOC4=C(C=C(C=C4)F)OCC5=CC=CC=C5

InChI

InChI=1S/C29H32FN3O2S/c30-24-11-12-26(27(19-24)35-21-23-7-2-1-3-8-23)34-18-6-15-33-16-13-22(14-17-33)20-31-29-32-25-9-4-5-10-28(25)36-29/h1-5,7-12,19,22H,6,13-18,20-21H2,(H,31,32)