1-[(2S)-3-(1-benzothiophen-4-yloxy)-2-oxidanyl-propyl]-4-quinolin-3-yl-piperidin-4-ol

Systemtic Name: 1-[(2S)-3-(1-benzothiophen-4-yloxy)-2-oxidanyl-propyl]-4-quinolin-3-yl-piperidin-4-ol Openeye Name: 1-[(2S)-3-(benzothiophen-4-yloxy)-2-hydroxy-propyl]-4-(3-quinolyl)piperidin-4-ol CAS Name: 1-[(2S)-3-(1-benzothiophen-4-yloxy)-2-hydroxypropyl]-4-(3-quinolinyl)-4-piperidinol IUPAC Name: 1-[(2S)-3-(1-benzothiophen-4-yloxy)-2-hydroxypropyl]-4-quinolin-3-ylpiperidin-4-ol Traditional Name: 1-[(2S)-3-(benzothiophen-4-yloxy)-2-hydroxy-propyl]-4-(3-quinolyl)piperidin-4-ol Formula: C25H26N2O3S MolecularWeight: 434.55054

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(C2=CC3=CC=CC=C3N=C2)O)CC(COC4=C5C=CSC5=CC=C4)O

Isomeric SMILES

C1CN(CCC1(C2=CC3=CC=CC=C3N=C2)O)C[C@@H](COC4=C5C=CSC5=CC=C4)O

InChI

InChI=1S/C25H26N2O3S/c28-20(17-30-23-6-3-7-24-21(23)8-13-31-24)16-27-11-9-25(29,10-12-27)19-14-18-4-1-2-5-22(18)26-15-19/h1-8,13-15,20,28-29H,9-12,16-17H2/t20-/m0/s1