3-[3-(hydroxymethyl)-1-(3-thiophen-3-ylsulfanylpropyl)piperidin-4-yl]-1-(6-methoxyquinolin-4-yl)propan-1-ol

Systemtic Name: 3-[3-(hydroxymethyl)-1-(3-thiophen-3-ylsulfanylpropyl)piperidin-4-yl]-1-(6-methoxyquinolin-4-yl)propan-1-ol Openeye Name: 3-[3-(hydroxymethyl)-1-[3-(3-thienylsulfanyl)propyl]-4-piperidyl]-1-(6-methoxy-4-quinolyl)propan-1-ol CAS Name: 3-[3-(hydroxymethyl)-1-[3-(3-thiophenylthio)propyl]-4-piperidinyl]-1-(6-methoxy-4-quinolinyl)-1-propanol IUPAC Name: 3-[3-(hydroxymethyl)-1-(3-thiophen-3-ylsulfanylpropyl)piperidin-4-yl]-1-(6-methoxyquinolin-4-yl)propan-1-ol Traditional Name: 1-(6-methoxy-4-quinolyl)-3-[3-methylol-1-[3-(3-thienylthio)propyl]-4-piperidyl]propan-1-ol Formula: C26H34N2O3S2 MolecularWeight: 486.68976

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=CN=C2C=C1)C(CCC3CCN(CC3CO)CCCSC4=CSC=C4)O

Isomeric SMILES

COC1=CC2=C(C=CN=C2C=C1)C(CCC3CCN(CC3CO)CCCSC4=CSC=C4)O

InChI

InChI=1S/C26H34N2O3S2/c1-31-21-4-5-25-24(15-21)23(7-10-27-25)26(30)6-3-19-8-12-28(16-20(19)17-29)11-2-13-33-22-9-14-32-18-22/h4-5,7,9-10,14-15,18-20,26,29-30H,2-3,6,8,11-13,16-17H2,1H3