N-(3-acetamido-4-methyl-phenyl)-2-(3-ethylquinolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(3-acetamido-4-methyl-phenyl)-2-(3-ethylquinolin-2-yl)sulfanyl-ethanamide Openeye Name: N-(3-acetamido-4-methyl-phenyl)-2-[(3-ethyl-2-quinolyl)sulfanyl]acetamide CAS Name: N-(3-acetamido-4-methylphenyl)-2-[(3-ethyl-2-quinolinyl)thio]acetamide IUPAC Name: N-(3-acetamido-4-methylphenyl)-2-(3-ethylquinolin-2-yl)sulfanylacetamide Traditional Name: N-(3-acetamido-4-methyl-phenyl)-2-[(3-ethyl-2-quinolyl)thio]acetamide Formula: C22H23N3O2S MolecularWeight: 393.50192

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23N3O2S/c1-4-16-11-17-7-5-6-8-19(17)25-22(16)28-13-21(27)24-18-10-9-14(2)20(12-18)23-15(3)26/h5-12H,4,13H2,1-3H3,(H,23,26)(H,24,27)