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

Systemtic Name: N-(3-cyano-4,5-dimethyl-furan-2-yl)-2-(4,8-dimethylquinolin-2-yl)sulfanyl-propanamide Openeye Name: N-(3-cyano-4,5-dimethyl-2-furyl)-2-[(4,8-dimethyl-2-quinolyl)sulfanyl]propanamide CAS Name: N-(3-cyano-4,5-dimethyl-2-furanyl)-2-[(4,8-dimethyl-2-quinolinyl)thio]propanamide IUPAC Name: N-(3-cyano-4,5-dimethylfuran-2-yl)-2-(4,8-dimethylquinolin-2-yl)sulfanylpropanamide Traditional Name: N-(3-cyano-4,5-dimethyl-2-furyl)-2-[(4,8-dimethyl-2-quinolyl)thio]propionamide Formula: C21H21N3O2S MolecularWeight: 379.47534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=C(C=C2C)SC(C)C(=O)NC3=C(C(=C(O3)C)C)C#N

Isomeric SMILES

CC1=CC=CC2=C1N=C(C=C2C)SC(C)C(=O)NC3=C(C(=C(O3)C)C)C#N

InChI

InChI=1S/C21H21N3O2S/c1-11-7-6-8-16-12(2)9-18(23-19(11)16)27-15(5)20(25)24-21-17(10-22)13(3)14(4)26-21/h6-9,15H,1-5H3,(H,24,25)