3-[5-[(2-chloranylquinolin-3-yl)methylsulfanyl]-1,3,4-oxadiazol-2-yl]-N,N-diethyl-benzenesulfonamide

Systemtic Name: 3-[5-[(2-chloranylquinolin-3-yl)methylsulfanyl]-1,3,4-oxadiazol-2-yl]-N,N-diethyl-benzenesulfonamide Openeye Name: 3-[5-[(2-chloro-3-quinolyl)methylsulfanyl]-1,3,4-oxadiazol-2-yl]-N,N-diethyl-benzenesulfonamide CAS Name: 3-[5-[(2-chloro-3-quinolinyl)methylthio]-1,3,4-oxadiazol-2-yl]-N,N-diethylbenzenesulfonamide IUPAC Name: 3-[5-[(2-chloroquinolin-3-yl)methylsulfanyl]-1,3,4-oxadiazol-2-yl]-N,N-diethylbenzenesulfonamide Traditional Name: 3-[5-[(2-chloro-3-quinolyl)methylthio]-1,3,4-oxadiazol-2-yl]-N,N-diethyl-benzenesulfonamide Formula: C22H21ClN4O3S2 MolecularWeight: 489.01014

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C2=NN=C(O2)SCC3=CC4=CC=CC=C4N=C3Cl

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C2=NN=C(O2)SCC3=CC4=CC=CC=C4N=C3Cl

InChI

InChI=1S/C22H21ClN4O3S2/c1-3-27(4-2)32(28,29)18-10-7-9-16(13-18)21-25-26-22(30-21)31-14-17-12-15-8-5-6-11-19(15)24-20(17)23/h5-13H,3-4,14H2,1-2H3