1-[(2S)-3-[(2-methyl-1,3-benzothiazol-5-yl)oxy]-2-oxidanyl-propyl]-4-quinolin-3-yl-piperidin-4-ol

Systemtic Name: 1-[(2S)-3-[(2-methyl-1,3-benzothiazol-5-yl)oxy]-2-oxidanyl-propyl]-4-quinolin-3-yl-piperidin-4-ol Openeye Name: 1-[(2S)-2-hydroxy-3-[(2-methyl-1,3-benzothiazol-5-yl)oxy]propyl]-4-(3-quinolyl)piperidin-4-ol CAS Name: 1-[(2S)-2-hydroxy-3-[(2-methyl-1,3-benzothiazol-5-yl)oxy]propyl]-4-(3-quinolinyl)-4-piperidinol IUPAC Name: 1-[(2S)-2-hydroxy-3-[(2-methyl-1,3-benzothiazol-5-yl)oxy]propyl]-4-quinolin-3-ylpiperidin-4-ol Traditional Name: 1-[(2S)-2-hydroxy-3-[(2-methyl-1,3-benzothiazol-5-yl)oxy]propyl]-4-(3-quinolyl)piperidin-4-ol Formula: C25H27N3O3S MolecularWeight: 449.56518

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(S1)C=CC(=C2)OCC(CN3CCC(CC3)(C4=CC5=CC=CC=C5N=C4)O)O

Isomeric SMILES

CC1=NC2=C(S1)C=CC(=C2)OC[C@H](CN3CCC(CC3)(C4=CC5=CC=CC=C5N=C4)O)O

InChI

InChI=1S/C25H27N3O3S/c1-17-27-23-13-21(6-7-24(23)32-17)31-16-20(29)15-28-10-8-25(30,9-11-28)19-12-18-4-2-3-5-22(18)26-14-19/h2-7,12-14,20,29-30H,8-11,15-16H2,1H3/t20-/m0/s1