5-[(4,8-dimethylquinolin-2-yl)sulfanylmethyl]-3-(2-methoxyphenyl)-1,2,4-oxadiazole

Systemtic Name: 5-[(4,8-dimethylquinolin-2-yl)sulfanylmethyl]-3-(2-methoxyphenyl)-1,2,4-oxadiazole Openeye Name: 5-[(4,8-dimethyl-2-quinolyl)sulfanylmethyl]-3-(2-methoxyphenyl)-1,2,4-oxadiazole CAS Name: 5-[[(4,8-dimethyl-2-quinolinyl)thio]methyl]-3-(2-methoxyphenyl)-1,2,4-oxadiazole IUPAC Name: 5-[(4,8-dimethylquinolin-2-yl)sulfanylmethyl]-3-(2-methoxyphenyl)-1,2,4-oxadiazole Traditional Name: 5-[[(4,8-dimethyl-2-quinolyl)thio]methyl]-3-(2-methoxyphenyl)-1,2,4-oxadiazole Formula: C21H19N3O2S MolecularWeight: 377.45946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=C(C=C2C)SCC3=NC(=NO3)C4=CC=CC=C4OC

Isomeric SMILES

CC1=CC=CC2=C1N=C(C=C2C)SCC3=NC(=NO3)C4=CC=CC=C4OC

InChI

InChI=1S/C21H19N3O2S/c1-13-7-6-9-15-14(2)11-19(23-20(13)15)27-12-18-22-21(24-26-18)16-8-4-5-10-17(16)25-3/h4-11H,12H2,1-3H3