N-[2-(3,4-dimethoxyphenyl)ethyl]-2-quinolin-8-ylsulfanyl-ethanamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-quinolin-8-ylsulfanyl-ethanamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(8-quinolylsulfanyl)acetamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(8-quinolinylthio)acetamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-quinolin-8-ylsulfanylacetamide Traditional Name: N-homoveratryl-2-(8-quinolylthio)acetamide Formula: C21H22N2O3S MolecularWeight: 382.47598

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)CSC2=CC=CC3=C2N=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)CSC2=CC=CC3=C2N=CC=C3)OC

InChI

InChI=1S/C21H22N2O3S/c1-25-17-9-8-15(13-18(17)26-2)10-12-22-20(24)14-27-19-7-3-5-16-6-4-11-23-21(16)19/h3-9,11,13H,10,12,14H2,1-2H3,(H,22,24)