2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(5-chloranyl-8-oxidanyl-quinolin-7-yl)methyl]ethanamide

Systemtic Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(5-chloranyl-8-oxidanyl-quinolin-7-yl)methyl]ethanamide Openeye Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(5-chloro-8-hydroxy-7-quinolyl)methyl]acetamide CAS Name: 2-(1,3-benzothiazol-2-ylthio)-N-[(5-chloro-8-hydroxy-7-quinolinyl)methyl]acetamide IUPAC Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(5-chloro-8-hydroxyquinolin-7-yl)methyl]acetamide Traditional Name: 2-(1,3-benzothiazol-2-ylthio)-N-[(5-chloro-8-hydroxy-7-quinolyl)methyl]acetamide Formula: C19H14ClN3O2S2 MolecularWeight: 415.91636

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)SCC(=O)NCC3=CC(=C4C=CC=NC4=C3O)Cl

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)SCC(=O)NCC3=CC(=C4C=CC=NC4=C3O)Cl

InChI

InChI=1S/C19H14ClN3O2S2/c20-13-8-11(18(25)17-12(13)4-3-7-21-17)9-22-16(24)10-26-19-23-14-5-1-2-6-15(14)27-19/h1-8,25H,9-10H2,(H,22,24)