N-(3,4-dimethoxyphenyl)-2-(1-ethyl-2-oxidanylidene-quinolin-4-yl)sulfanyl-ethanamide

Systemtic Name: N-(3,4-dimethoxyphenyl)-2-(1-ethyl-2-oxidanylidene-quinolin-4-yl)sulfanyl-ethanamide Openeye Name: N-(3,4-dimethoxyphenyl)-2-[(1-ethyl-2-oxo-4-quinolyl)sulfanyl]acetamide CAS Name: N-(3,4-dimethoxyphenyl)-2-[(1-ethyl-2-oxo-4-quinolinyl)thio]acetamide IUPAC Name: N-(3,4-dimethoxyphenyl)-2-(1-ethyl-2-oxoquinolin-4-yl)sulfanylacetamide Traditional Name: N-(3,4-dimethoxyphenyl)-2-[(1-ethyl-2-keto-4-quinolyl)thio]acetamide Formula: C21H22N2O4S MolecularWeight: 398.47538

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2C(=CC1=O)SCC(=O)NC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CCN1C2=CC=CC=C2C(=CC1=O)SCC(=O)NC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C21H22N2O4S/c1-4-23-16-8-6-5-7-15(16)19(12-21(23)25)28-13-20(24)22-14-9-10-17(26-2)18(11-14)27-3/h5-12H,4,13H2,1-3H3,(H,22,24)