N-(1,3-benzothiazol-2-yl)-2-(8-methoxy-4-methyl-quinolin-2-yl)sulfanyl-propanamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-2-(8-methoxy-4-methyl-quinolin-2-yl)sulfanyl-propanamide Openeye Name: N-(1,3-benzothiazol-2-yl)-2-[(8-methoxy-4-methyl-2-quinolyl)sulfanyl]propanamide CAS Name: N-(1,3-benzothiazol-2-yl)-2-[(8-methoxy-4-methyl-2-quinolinyl)thio]propanamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-2-(8-methoxy-4-methylquinolin-2-yl)sulfanylpropanamide Traditional Name: N-(1,3-benzothiazol-2-yl)-2-[(8-methoxy-4-methyl-2-quinolyl)thio]propionamide Formula: C21H19N3O2S2 MolecularWeight: 409.52446

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C=CC=C2OC)SC(C)C(=O)NC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=CC(=NC2=C1C=CC=C2OC)SC(C)C(=O)NC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H19N3O2S2/c1-12-11-18(23-19-14(12)7-6-9-16(19)26-3)27-13(2)20(25)24-21-22-15-8-4-5-10-17(15)28-21/h4-11,13H,1-3H3,(H,22,24,25)