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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H32ClN3O2S/c1-32-20-4-5-25-23(17-20)22(24(27)18-29-25)3-2-8-26(19-31)9-13-30(14-10-26)15-16-33-21-6-11-28-12-7-21/h4-7,11-12,17-18,31H,2-3,8-10,13-16,19H2,1H3