1-phenoxy-3-[4-(8-thiophen-3-ylquinolin-2-yl)piperazin-1-yl]propan-2-ol

Systemtic Name: 1-phenoxy-3-[4-(8-thiophen-3-ylquinolin-2-yl)piperazin-1-yl]propan-2-ol Openeye Name: 1-phenoxy-3-[4-[8-(3-thienyl)-2-quinolyl]piperazin-1-yl]propan-2-ol CAS Name: 1-phenoxy-3-[4-[8-(3-thiophenyl)-2-quinolinyl]-1-piperazinyl]-2-propanol IUPAC Name: 1-phenoxy-3-[4-(8-thiophen-3-ylquinolin-2-yl)piperazin-1-yl]propan-2-ol Traditional Name: 1-phenoxy-3-[4-[8-(3-thienyl)-2-quinolyl]piperazino]propan-2-ol Formula: C26H27N3O2S MolecularWeight: 445.57648

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(COC2=CC=CC=C2)O)C3=NC4=C(C=CC=C4C5=CSC=C5)C=C3

Isomeric SMILES

C1CN(CCN1CC(COC2=CC=CC=C2)O)C3=NC4=C(C=CC=C4C5=CSC=C5)C=C3

InChI

InChI=1S/C26H27N3O2S/c30-22(18-31-23-6-2-1-3-7-23)17-28-12-14-29(15-13-28)25-10-9-20-5-4-8-24(26(20)27-25)21-11-16-32-19-21/h1-11,16,19,22,30H,12-15,17-18H2