2-[3-(2,5-dimethoxyphenyl)quinolin-2-yl]sulfanyl-N,N-dimethyl-ethanamine hydrochloride

Systemtic Name: 2-[3-(2,5-dimethoxyphenyl)quinolin-2-yl]sulfanyl-N,N-dimethyl-ethanamine hydrochloride Openeye Name: 2-[[3-(2,5-dimethoxyphenyl)-2-quinolyl]sulfanyl]-N,N-dimethyl-ethanamine hydrochloride CAS Name: 2-[[3-(2,5-dimethoxyphenyl)-2-quinolinyl]thio]-N,N-dimethylethanamine hydrochloride IUPAC Name: 2-[3-(2,5-dimethoxyphenyl)quinolin-2-yl]sulfanyl-N,N-dimethylethanamine hydrochloride Traditional Name: 2-[[3-(2,5-dimethoxyphenyl)-2-quinolyl]thio]ethyl-dimethyl-amine hydrochloride Formula: C21H25ClN2O2S MolecularWeight: 404.9534

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCSC1=NC2=CC=CC=C2C=C1C3=C(C=CC(=C3)OC)OC.Cl

Isomeric SMILES

CN(C)CCSC1=NC2=CC=CC=C2C=C1C3=C(C=CC(=C3)OC)OC.Cl

InChI

InChI=1S/C21H24N2O2S.ClH/c1-23(2)11-12-26-21-18(13-15-7-5-6-8-19(15)22-21)17-14-16(24-3)9-10-20(17)25-4;/h5-10,13-14H,11-12H2,1-4H3;1H