2-[2-hydroxyethyl-[7-methylsulfanyl-2-(phenylmethylsulfanyl)quinolin-3-yl]amino]ethanol

Systemtic Name: 2-[2-hydroxyethyl-[7-methylsulfanyl-2-(phenylmethylsulfanyl)quinolin-3-yl]amino]ethanol Openeye Name: 2-[(2-benzylsulfanyl-7-methylsulfanyl-3-quinolyl)-(2-hydroxyethyl)amino]ethanol CAS Name: 2-[2-hydroxyethyl-[7-(methylthio)-2-(phenylmethylthio)-3-quinolinyl]amino]ethanol IUPAC Name: 2-[(2-benzylsulfanyl-7-methylsulfanylquinolin-3-yl)-(2-hydroxyethyl)amino]ethanol Traditional Name: 2-[[2-(benzylthio)-7-(methylthio)-3-quinolyl]-(2-hydroxyethyl)amino]ethanol Formula: C21H24N2O2S2 MolecularWeight: 400.55746

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC2=NC(=C(C=C2C=C1)N(CCO)CCO)SCC3=CC=CC=C3

Isomeric SMILES

CSC1=CC2=NC(=C(C=C2C=C1)N(CCO)CCO)SCC3=CC=CC=C3

InChI

InChI=1S/C21H24N2O2S2/c1-26-18-8-7-17-13-20(23(9-11-24)10-12-25)21(22-19(17)14-18)27-15-16-5-3-2-4-6-16/h2-8,13-14,24-25H,9-12,15H2,1H3