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

Systemtic Name: 2-(3-cyano-6-methyl-quinolin-2-yl)sulfanyl-N-(6-methoxy-1,3-benzothiazol-2-yl)ethanamide Openeye Name: 2-[(3-cyano-6-methyl-2-quinolyl)sulfanyl]-N-(6-methoxy-1,3-benzothiazol-2-yl)acetamide CAS Name: 2-[(3-cyano-6-methyl-2-quinolinyl)thio]-N-(6-methoxy-1,3-benzothiazol-2-yl)acetamide IUPAC Name: 2-(3-cyano-6-methylquinolin-2-yl)sulfanyl-N-(6-methoxy-1,3-benzothiazol-2-yl)acetamide Traditional Name: 2-[(3-cyano-6-methyl-2-quinolyl)thio]-N-(6-methoxy-1,3-benzothiazol-2-yl)acetamide Formula: C21H16N4O2S2 MolecularWeight: 420.50734

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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=C(C=C4)OC

Isomeric SMILES

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

InChI

InChI=1S/C21H16N4O2S2/c1-12-3-5-16-13(7-12)8-14(10-22)20(23-16)28-11-19(26)25-21-24-17-6-4-15(27-2)9-18(17)29-21/h3-9H,11H2,1-2H3,(H,24,25,26)