5-(phenylsulfanylmethyl)-7-(piperidin-1-ylmethyl)quinolin-8-ol hydrochloride

Systemtic Name: 5-(phenylsulfanylmethyl)-7-(piperidin-1-ylmethyl)quinolin-8-ol hydrochloride Openeye Name: 5-(phenylsulfanylmethyl)-7-(1-piperidylmethyl)quinolin-8-ol hydrochloride CAS Name: 5-[(phenylthio)methyl]-7-(1-piperidinylmethyl)-8-quinolinol hydrochloride IUPAC Name: 5-(phenylsulfanylmethyl)-7-(piperidin-1-ylmethyl)quinolin-8-ol hydrochloride Traditional Name: 5-[(phenylthio)methyl]-7-(piperidinomethyl)quinolin-8-ol hydrochloride Formula: C22H25ClN2OS MolecularWeight: 400.9647

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=C(C3=C(C=CC=N3)C(=C2)CSC4=CC=CC=C4)O.Cl

Isomeric SMILES

C1CCN(CC1)CC2=C(C3=C(C=CC=N3)C(=C2)CSC4=CC=CC=C4)O.Cl

InChI

InChI=1S/C22H24N2OS.ClH/c25-22-17(15-24-12-5-2-6-13-24)14-18(20-10-7-11-23-21(20)22)16-26-19-8-3-1-4-9-19;/h1,3-4,7-11,14,25H,2,5-6,12-13,15-16H2;1H