N-[(2,5-dimethoxyphenyl)methyl]-2-(1-methyl-2-oxidanylidene-quinolin-4-yl)sulfanyl-ethanamide

Systemtic Name: N-[(2,5-dimethoxyphenyl)methyl]-2-(1-methyl-2-oxidanylidene-quinolin-4-yl)sulfanyl-ethanamide Openeye Name: N-[(2,5-dimethoxyphenyl)methyl]-2-[(1-methyl-2-oxo-4-quinolyl)sulfanyl]acetamide CAS Name: N-[(2,5-dimethoxyphenyl)methyl]-2-[(1-methyl-2-oxo-4-quinolinyl)thio]acetamide IUPAC Name: N-[(2,5-dimethoxyphenyl)methyl]-2-(1-methyl-2-oxoquinolin-4-yl)sulfanylacetamide Traditional Name: N-(2,5-dimethoxybenzyl)-2-[(2-keto-1-methyl-4-quinolyl)thio]acetamide Formula: C21H22N2O4S MolecularWeight: 398.47538

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=CC1=O)SCC(=O)NCC3=C(C=CC(=C3)OC)OC

Isomeric SMILES

CN1C2=CC=CC=C2C(=CC1=O)SCC(=O)NCC3=C(C=CC(=C3)OC)OC

InChI

InChI=1S/C21H22N2O4S/c1-23-17-7-5-4-6-16(17)19(11-21(23)25)28-13-20(24)22-12-14-10-15(26-2)8-9-18(14)27-3/h4-11H,12-13H2,1-3H3,(H,22,24)