2-[(3-chloranyl-4-methyl-quinolin-2-yl)methylsulfanyl]-5-[(4-methoxyphenyl)methyl]-1,3,4-oxadiazole

Systemtic Name: 2-[(3-chloranyl-4-methyl-quinolin-2-yl)methylsulfanyl]-5-[(4-methoxyphenyl)methyl]-1,3,4-oxadiazole Openeye Name: 2-[(3-chloro-4-methyl-2-quinolyl)methylsulfanyl]-5-[(4-methoxyphenyl)methyl]-1,3,4-oxadiazole CAS Name: 2-[(3-chloro-4-methyl-2-quinolinyl)methylthio]-5-[(4-methoxyphenyl)methyl]-1,3,4-oxadiazole IUPAC Name: 2-[(3-chloro-4-methylquinolin-2-yl)methylsulfanyl]-5-[(4-methoxyphenyl)methyl]-1,3,4-oxadiazole Traditional Name: 2-[(3-chloro-4-methyl-2-quinolyl)methylthio]-5-p-anisyl-1,3,4-oxadiazole Formula: C21H18ClN3O2S MolecularWeight: 411.90452

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=CC=CC=C12)CSC3=NN=C(O3)CC4=CC=C(C=C4)OC)Cl

Isomeric SMILES

CC1=C(C(=NC2=CC=CC=C12)CSC3=NN=C(O3)CC4=CC=C(C=C4)OC)Cl

InChI

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