N-(6-chloranyl-1,3-benzothiazol-2-yl)-2-(8-methoxy-4-methyl-quinolin-2-yl)sulfanyl-propanamide

Systemtic Name: N-(6-chloranyl-1,3-benzothiazol-2-yl)-2-(8-methoxy-4-methyl-quinolin-2-yl)sulfanyl-propanamide Openeye Name: N-(6-chloro-1,3-benzothiazol-2-yl)-2-[(8-methoxy-4-methyl-2-quinolyl)sulfanyl]propanamide CAS Name: N-(6-chloro-1,3-benzothiazol-2-yl)-2-[(8-methoxy-4-methyl-2-quinolinyl)thio]propanamide IUPAC Name: N-(6-chloro-1,3-benzothiazol-2-yl)-2-(8-methoxy-4-methylquinolin-2-yl)sulfanylpropanamide Traditional Name: N-(6-chloro-1,3-benzothiazol-2-yl)-2-[(8-methoxy-4-methyl-2-quinolyl)thio]propionamide Formula: C21H18ClN3O2S2 MolecularWeight: 443.96952

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C=CC=C2OC)SC(C)C(=O)NC3=NC4=C(S3)C=C(C=C4)Cl

Isomeric SMILES

CC1=CC(=NC2=C1C=CC=C2OC)SC(C)C(=O)NC3=NC4=C(S3)C=C(C=C4)Cl

InChI

InChI=1S/C21H18ClN3O2S2/c1-11-9-18(24-19-14(11)5-4-6-16(19)27-3)28-12(2)20(26)25-21-23-15-8-7-13(22)10-17(15)29-21/h4-10,12H,1-3H3,(H,23,25,26)