2-[2-(4-chlorophenyl)quinolin-4-yl]-5-(2-ethoxyethylsulfanyl)-1,3,4-oxadiazole

Systemtic Name: 2-[2-(4-chlorophenyl)quinolin-4-yl]-5-(2-ethoxyethylsulfanyl)-1,3,4-oxadiazole Openeye Name: 2-[2-(4-chlorophenyl)-4-quinolyl]-5-(2-ethoxyethylsulfanyl)-1,3,4-oxadiazole CAS Name: 2-[2-(4-chlorophenyl)-4-quinolinyl]-5-(2-ethoxyethylthio)-1,3,4-oxadiazole IUPAC Name: 2-[2-(4-chlorophenyl)quinolin-4-yl]-5-(2-ethoxyethylsulfanyl)-1,3,4-oxadiazole Traditional Name: 2-[2-(4-chlorophenyl)-4-quinolyl]-5-(2-ethoxyethylthio)-1,3,4-oxadiazole Formula: C21H18ClN3O2S MolecularWeight: 411.90452

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCSC1=NN=C(O1)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)Cl

Isomeric SMILES

CCOCCSC1=NN=C(O1)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H18ClN3O2S/c1-2-26-11-12-28-21-25-24-20(27-21)17-13-19(14-7-9-15(22)10-8-14)23-18-6-4-3-5-16(17)18/h3-10,13H,2,11-12H2,1H3