4-(1,3-benzothiazol-2-yl)-N-(8-methylquinolin-5-yl)butanamide

Systemtic Name: 4-(1,3-benzothiazol-2-yl)-N-(8-methylquinolin-5-yl)butanamide Openeye Name: 4-(1,3-benzothiazol-2-yl)-N-(8-methyl-5-quinolyl)butanamide CAS Name: 4-(1,3-benzothiazol-2-yl)-N-(8-methyl-5-quinolinyl)butanamide IUPAC Name: 4-(1,3-benzothiazol-2-yl)-N-(8-methylquinolin-5-yl)butanamide Traditional Name: 4-(1,3-benzothiazol-2-yl)-N-(8-methyl-5-quinolyl)butyramide Formula: C21H19N3OS MolecularWeight: 361.46006

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)NC(=O)CCCC3=NC4=CC=CC=C4S3)C=CC=N2

Isomeric SMILES

CC1=C2C(=C(C=C1)NC(=O)CCCC3=NC4=CC=CC=C4S3)C=CC=N2

InChI

InChI=1S/C21H19N3OS/c1-14-11-12-16(15-6-5-13-22-21(14)15)23-19(25)9-4-10-20-24-17-7-2-3-8-18(17)26-20/h2-3,5-8,11-13H,4,9-10H2,1H3,(H,23,25)