N-(3-cyano-4,5-dimethyl-thiophen-2-yl)-3-(8-methoxy-4-methyl-quinolin-2-yl)sulfanyl-propanamide

Systemtic Name: N-(3-cyano-4,5-dimethyl-thiophen-2-yl)-3-(8-methoxy-4-methyl-quinolin-2-yl)sulfanyl-propanamide Openeye Name: N-(3-cyano-4,5-dimethyl-2-thienyl)-3-[(8-methoxy-4-methyl-2-quinolyl)sulfanyl]propanamide CAS Name: N-(3-cyano-4,5-dimethyl-2-thiophenyl)-3-[(8-methoxy-4-methyl-2-quinolinyl)thio]propanamide IUPAC Name: N-(3-cyano-4,5-dimethylthiophen-2-yl)-3-(8-methoxy-4-methylquinolin-2-yl)sulfanylpropanamide Traditional Name: N-(3-cyano-4,5-dimethyl-2-thienyl)-3-[(8-methoxy-4-methyl-2-quinolyl)thio]propionamide Formula: C21H21N3O2S2 MolecularWeight: 411.54034

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C=CC=C2OC)SCCC(=O)NC3=C(C(=C(S3)C)C)C#N

Isomeric SMILES

CC1=CC(=NC2=C1C=CC=C2OC)SCCC(=O)NC3=C(C(=C(S3)C)C)C#N

InChI

InChI=1S/C21H21N3O2S2/c1-12-10-19(24-20-15(12)6-5-7-17(20)26-4)27-9-8-18(25)23-21-16(11-22)13(2)14(3)28-21/h5-7,10H,8-9H2,1-4H3,(H,23,25)