N-(3-cyano-4,5-dimethyl-thiophen-2-yl)-2-(3-cyano-7-ethoxy-quinolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(3-cyano-4,5-dimethyl-thiophen-2-yl)-2-(3-cyano-7-ethoxy-quinolin-2-yl)sulfanyl-ethanamide Openeye Name: N-(3-cyano-4,5-dimethyl-2-thienyl)-2-[(3-cyano-7-ethoxy-2-quinolyl)sulfanyl]acetamide CAS Name: N-(3-cyano-4,5-dimethyl-2-thiophenyl)-2-[(3-cyano-7-ethoxy-2-quinolinyl)thio]acetamide IUPAC Name: N-(3-cyano-4,5-dimethylthiophen-2-yl)-2-(3-cyano-7-ethoxyquinolin-2-yl)sulfanylacetamide Traditional Name: N-(3-cyano-4,5-dimethyl-2-thienyl)-2-[(3-cyano-7-ethoxy-2-quinolyl)thio]acetamide Formula: C21H18N4O2S2 MolecularWeight: 422.52322

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)C=C(C(=N2)SCC(=O)NC3=C(C(=C(S3)C)C)C#N)C#N

Isomeric SMILES

CCOC1=CC2=C(C=C1)C=C(C(=N2)SCC(=O)NC3=C(C(=C(S3)C)C)C#N)C#N

InChI

InChI=1S/C21H18N4O2S2/c1-4-27-16-6-5-14-7-15(9-22)20(24-18(14)8-16)28-11-19(26)25-21-17(10-23)12(2)13(3)29-21/h5-8H,4,11H2,1-3H3,(H,25,26)