N-(3-cyano-4,5-dimethyl-thiophen-2-yl)-2-(4-methyl-2-oxidanylidene-quinolin-1-yl)butanamide

Systemtic Name: N-(3-cyano-4,5-dimethyl-thiophen-2-yl)-2-(4-methyl-2-oxidanylidene-quinolin-1-yl)butanamide Openeye Name: N-(3-cyano-4,5-dimethyl-2-thienyl)-2-(4-methyl-2-oxo-1-quinolyl)butanamide CAS Name: N-(3-cyano-4,5-dimethyl-2-thiophenyl)-2-(4-methyl-2-oxo-1-quinolinyl)butanamide IUPAC Name: N-(3-cyano-4,5-dimethylthiophen-2-yl)-2-(4-methyl-2-oxoquinolin-1-yl)butanamide Traditional Name: N-(3-cyano-4,5-dimethyl-2-thienyl)-2-(2-keto-4-methyl-1-quinolyl)butyramide Formula: C21H21N3O2S MolecularWeight: 379.47534

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=C(C(=C(S1)C)C)C#N)N2C3=CC=CC=C3C(=CC2=O)C

Isomeric SMILES

CCC(C(=O)NC1=C(C(=C(S1)C)C)C#N)N2C3=CC=CC=C3C(=CC2=O)C

InChI

InChI=1S/C21H21N3O2S/c1-5-17(20(26)23-21-16(11-22)13(3)14(4)27-21)24-18-9-7-6-8-15(18)12(2)10-19(24)25/h6-10,17H,5H2,1-4H3,(H,23,26)