1-(2-azanyl-1,3-benzothiazol-6-yl)-3-phenoxy-2-[4-(phenylmethyl)piperidin-1-yl]propan-1-ol

Systemtic Name: 1-(2-azanyl-1,3-benzothiazol-6-yl)-3-phenoxy-2-[4-(phenylmethyl)piperidin-1-yl]propan-1-ol Openeye Name: 1-(2-amino-1,3-benzothiazol-6-yl)-2-(4-benzyl-1-piperidyl)-3-phenoxy-propan-1-ol CAS Name: 1-(2-amino-1,3-benzothiazol-6-yl)-3-phenoxy-2-[4-(phenylmethyl)-1-piperidinyl]-1-propanol IUPAC Name: 1-(2-amino-1,3-benzothiazol-6-yl)-2-(4-benzylpiperidin-1-yl)-3-phenoxypropan-1-ol Traditional Name: 1-(2-amino-1,3-benzothiazol-6-yl)-2-(4-benzylpiperidino)-3-phenoxy-propan-1-ol Formula: C28H31N3O2S MolecularWeight: 473.62964

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)C(COC3=CC=CC=C3)C(C4=CC5=C(C=C4)N=C(S5)N)O

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)C(COC3=CC=CC=C3)C(C4=CC5=C(C=C4)N=C(S5)N)O

InChI

InChI=1S/C28H31N3O2S/c29-28-30-24-12-11-22(18-26(24)34-28)27(32)25(19-33-23-9-5-2-6-10-23)31-15-13-21(14-16-31)17-20-7-3-1-4-8-20/h1-12,18,21,25,27,32H,13-17,19H2,(H2,29,30)