2-(3-ethyl-5,8-dimethyl-quinolin-2-yl)sulfanyl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)ethanamide

Systemtic Name: 2-(3-ethyl-5,8-dimethyl-quinolin-2-yl)sulfanyl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)ethanamide Openeye Name: 2-[(3-ethyl-5,8-dimethyl-2-quinolyl)sulfanyl]-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)acetamide CAS Name: 2-[(3-ethyl-5,8-dimethyl-2-quinolinyl)thio]-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)acetamide IUPAC Name: 2-(3-ethyl-5,8-dimethylquinolin-2-yl)sulfanyl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)acetamide Traditional Name: 2-[(3-ethyl-5,8-dimethyl-2-quinolyl)thio]-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)acetamide Formula: C22H25N3OS2 MolecularWeight: 411.5834

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=CC(=C2N=C1SCC(=O)NC3=NC4=C(S3)CCCC4)C)C

Isomeric SMILES

CCC1=CC2=C(C=CC(=C2N=C1SCC(=O)NC3=NC4=C(S3)CCCC4)C)C

InChI

InChI=1S/C22H25N3OS2/c1-4-15-11-16-13(2)9-10-14(3)20(16)25-21(15)27-12-19(26)24-22-23-17-7-5-6-8-18(17)28-22/h9-11H,4-8,12H2,1-3H3,(H,23,24,26)