[4-[3-(3-chloranyl-6-methoxy-quinolin-4-yl)propyl]-1-(2-pyridin-3-ylsulfanylethyl)piperidin-4-yl]methanol

Systemtic Name: [4-[3-(3-chloranyl-6-methoxy-quinolin-4-yl)propyl]-1-(2-pyridin-3-ylsulfanylethyl)piperidin-4-yl]methanol Openeye Name: [4-[3-(3-chloro-6-methoxy-4-quinolyl)propyl]-1-[2-(3-pyridylsulfanyl)ethyl]-4-piperidyl]methanol CAS Name: [4-[3-(3-chloro-6-methoxy-4-quinolinyl)propyl]-1-[2-(3-pyridinylthio)ethyl]-4-piperidinyl]methanol IUPAC Name: [4-[3-(3-chloro-6-methoxyquinolin-4-yl)propyl]-1-(2-pyridin-3-ylsulfanylethyl)piperidin-4-yl]methanol Traditional Name: [4-[3-(3-chloro-6-methoxy-4-quinolyl)propyl]-1-[2-(3-pyridylthio)ethyl]-4-piperidyl]methanol Formula: C26H32ClN3O2S MolecularWeight: 486.06918

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C(=CN=C2C=C1)Cl)CCCC3(CCN(CC3)CCSC4=CN=CC=C4)CO

Isomeric SMILES

COC1=CC2=C(C(=CN=C2C=C1)Cl)CCCC3(CCN(CC3)CCSC4=CN=CC=C4)CO

InChI

InChI=1S/C26H32ClN3O2S/c1-32-20-6-7-25-23(16-20)22(24(27)18-29-25)5-2-8-26(19-31)9-12-30(13-10-26)14-15-33-21-4-3-11-28-17-21/h3-4,6-7,11,16-18,31H,2,5,8-10,12-15,19H2,1H3