N-(3-acetamidophenyl)-2-(3-ethyl-6,8-dimethyl-quinolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(3-acetamidophenyl)-2-(3-ethyl-6,8-dimethyl-quinolin-2-yl)sulfanyl-ethanamide Openeye Name: N-(3-acetamidophenyl)-2-[(3-ethyl-6,8-dimethyl-2-quinolyl)sulfanyl]acetamide CAS Name: N-(3-acetamidophenyl)-2-[(3-ethyl-6,8-dimethyl-2-quinolinyl)thio]acetamide IUPAC Name: N-(3-acetamidophenyl)-2-(3-ethyl-6,8-dimethylquinolin-2-yl)sulfanylacetamide Traditional Name: N-(3-acetamidophenyl)-2-[(3-ethyl-6,8-dimethyl-2-quinolyl)thio]acetamide Formula: C23H25N3O2S MolecularWeight: 407.5285

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=CC(=CC(=C2N=C1SCC(=O)NC3=CC=CC(=C3)NC(=O)C)C)C

Isomeric SMILES

CCC1=CC2=CC(=CC(=C2N=C1SCC(=O)NC3=CC=CC(=C3)NC(=O)C)C)C

InChI

InChI=1S/C23H25N3O2S/c1-5-17-11-18-10-14(2)9-15(3)22(18)26-23(17)29-13-21(28)25-20-8-6-7-19(12-20)24-16(4)27/h6-12H,5,13H2,1-4H3,(H,24,27)(H,25,28)