N-(3-cyano-4,5-dimethyl-furan-2-yl)-2-(4,6,8-trimethylquinolin-2-yl)sulfanyl-propanamide

Systemtic Name: N-(3-cyano-4,5-dimethyl-furan-2-yl)-2-(4,6,8-trimethylquinolin-2-yl)sulfanyl-propanamide Openeye Name: N-(3-cyano-4,5-dimethyl-2-furyl)-2-[(4,6,8-trimethyl-2-quinolyl)sulfanyl]propanamide CAS Name: N-(3-cyano-4,5-dimethyl-2-furanyl)-2-[(4,6,8-trimethyl-2-quinolinyl)thio]propanamide IUPAC Name: N-(3-cyano-4,5-dimethylfuran-2-yl)-2-(4,6,8-trimethylquinolin-2-yl)sulfanylpropanamide Traditional Name: N-(3-cyano-4,5-dimethyl-2-furyl)-2-[(4,6,8-trimethyl-2-quinolyl)thio]propionamide Formula: C22H23N3O2S MolecularWeight: 393.50192

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=CC(=N2)SC(C)C(=O)NC3=C(C(=C(O3)C)C)C#N)C)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=CC(=N2)SC(C)C(=O)NC3=C(C(=C(O3)C)C)C#N)C)C

InChI

InChI=1S/C22H23N3O2S/c1-11-7-13(3)20-17(8-11)12(2)9-19(24-20)28-16(6)21(26)25-22-18(10-23)14(4)15(5)27-22/h7-9,16H,1-6H3,(H,25,26)