N-(3-cyano-4,5-dimethyl-thiophen-2-yl)-2-(3-ethyl-6-methoxy-quinolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(3-cyano-4,5-dimethyl-thiophen-2-yl)-2-(3-ethyl-6-methoxy-quinolin-2-yl)sulfanyl-ethanamide Openeye Name: N-(3-cyano-4,5-dimethyl-2-thienyl)-2-[(3-ethyl-6-methoxy-2-quinolyl)sulfanyl]acetamide CAS Name: N-(3-cyano-4,5-dimethyl-2-thiophenyl)-2-[(3-ethyl-6-methoxy-2-quinolinyl)thio]acetamide IUPAC Name: N-(3-cyano-4,5-dimethylthiophen-2-yl)-2-(3-ethyl-6-methoxyquinolin-2-yl)sulfanylacetamide Traditional Name: N-(3-cyano-4,5-dimethyl-2-thienyl)-2-[(3-ethyl-6-methoxy-2-quinolyl)thio]acetamide Formula: C21H21N3O2S2 MolecularWeight: 411.54034

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=C2C=CC(=CC2=C1)OC)SCC(=O)NC3=C(C(=C(S3)C)C)C#N

Isomeric SMILES

CCC1=C(N=C2C=CC(=CC2=C1)OC)SCC(=O)NC3=C(C(=C(S3)C)C)C#N

InChI

InChI=1S/C21H21N3O2S2/c1-5-14-8-15-9-16(26-4)6-7-18(15)23-20(14)27-11-19(25)24-21-17(10-22)12(2)13(3)28-21/h6-9H,5,11H2,1-4H3,(H,24,25)