2-(1,3-benzothiazol-2-ylsulfanyl)-N-(2,6,8-trimethylquinolin-4-yl)ethanamide

Systemtic Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-(2,6,8-trimethylquinolin-4-yl)ethanamide Openeye Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-(2,6,8-trimethyl-4-quinolyl)acetamide CAS Name: 2-(1,3-benzothiazol-2-ylthio)-N-(2,6,8-trimethyl-4-quinolinyl)acetamide IUPAC Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-(2,6,8-trimethylquinolin-4-yl)acetamide Traditional Name: 2-(1,3-benzothiazol-2-ylthio)-N-(2,6,8-trimethyl-4-quinolyl)acetamide Formula: C21H19N3OS2 MolecularWeight: 393.52506

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=CC(=N2)C)NC(=O)CSC3=NC4=CC=CC=C4S3)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=CC(=N2)C)NC(=O)CSC3=NC4=CC=CC=C4S3)C

InChI

InChI=1S/C21H19N3OS2/c1-12-8-13(2)20-15(9-12)17(10-14(3)22-20)23-19(25)11-26-21-24-16-6-4-5-7-18(16)27-21/h4-10H,11H2,1-3H3,(H,22,23,25)