N-(3-acetamidophenyl)-2-(3-ethyl-5,7-dimethyl-quinolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(3-acetamidophenyl)-2-(3-ethyl-5,7-dimethyl-quinolin-2-yl)sulfanyl-ethanamide Openeye Name: N-(3-acetamidophenyl)-2-[(3-ethyl-5,7-dimethyl-2-quinolyl)sulfanyl]acetamide CAS Name: N-(3-acetamidophenyl)-2-[(3-ethyl-5,7-dimethyl-2-quinolinyl)thio]acetamide IUPAC Name: N-(3-acetamidophenyl)-2-(3-ethyl-5,7-dimethylquinolin-2-yl)sulfanylacetamide Traditional Name: N-(3-acetamidophenyl)-2-[(3-ethyl-5,7-dimethyl-2-quinolyl)thio]acetamide Formula: C23H25N3O2S MolecularWeight: 407.5285

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=C2C=C(C=C(C2=C1)C)C)SCC(=O)NC3=CC=CC(=C3)NC(=O)C

Isomeric SMILES

CCC1=C(N=C2C=C(C=C(C2=C1)C)C)SCC(=O)NC3=CC=CC(=C3)NC(=O)C

InChI

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