2-(3-cyano-6-methyl-quinolin-2-yl)sulfanyl-N-(5-methyl-1,3-benzothiazol-2-yl)ethanamide

Systemtic Name: 2-(3-cyano-6-methyl-quinolin-2-yl)sulfanyl-N-(5-methyl-1,3-benzothiazol-2-yl)ethanamide Openeye Name: 2-[(3-cyano-6-methyl-2-quinolyl)sulfanyl]-N-(5-methyl-1,3-benzothiazol-2-yl)acetamide CAS Name: 2-[(3-cyano-6-methyl-2-quinolinyl)thio]-N-(5-methyl-1,3-benzothiazol-2-yl)acetamide IUPAC Name: 2-(3-cyano-6-methylquinolin-2-yl)sulfanyl-N-(5-methyl-1,3-benzothiazol-2-yl)acetamide Traditional Name: 2-[(3-cyano-6-methyl-2-quinolyl)thio]-N-(5-methyl-1,3-benzothiazol-2-yl)acetamide Formula: C21H16N4OS2 MolecularWeight: 404.50794

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(C(=C2)C#N)SCC(=O)NC3=NC4=C(S3)C=CC(=C4)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(C(=C2)C#N)SCC(=O)NC3=NC4=C(S3)C=CC(=C4)C

InChI

InChI=1S/C21H16N4OS2/c1-12-3-5-16-14(7-12)9-15(10-22)20(23-16)27-11-19(26)25-21-24-17-8-13(2)4-6-18(17)28-21/h3-9H,11H2,1-2H3,(H,24,25,26)