4-(1,3-benzothiazol-2-ylmethylamino)-1-(2-oxidanyl-3-phenoxy-propyl)piperidin-3-ol

Systemtic Name: 4-(1,3-benzothiazol-2-ylmethylamino)-1-(2-oxidanyl-3-phenoxy-propyl)piperidin-3-ol Openeye Name: 4-(1,3-benzothiazol-2-ylmethylamino)-1-(2-hydroxy-3-phenoxy-propyl)piperidin-3-ol CAS Name: 4-(1,3-benzothiazol-2-ylmethylamino)-1-(2-hydroxy-3-phenoxypropyl)-3-piperidinol IUPAC Name: 4-(1,3-benzothiazol-2-ylmethylamino)-1-(2-hydroxy-3-phenoxypropyl)piperidin-3-ol Traditional Name: 4-(1,3-benzothiazol-2-ylmethylamino)-1-(2-hydroxy-3-phenoxy-propyl)piperidin-3-ol Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(C1NCC2=NC3=CC=CC=C3S2)O)CC(COC4=CC=CC=C4)O

Isomeric SMILES

C1CN(CC(C1NCC2=NC3=CC=CC=C3S2)O)CC(COC4=CC=CC=C4)O

InChI

InChI=1S/C22H27N3O3S/c26-16(15-28-17-6-2-1-3-7-17)13-25-11-10-18(20(27)14-25)23-12-22-24-19-8-4-5-9-21(19)29-22/h1-9,16,18,20,23,26-27H,10-15H2