3-(3,4-dimethoxyphenyl)-5-(quinolin-2-ylsulfanylmethyl)-1,2,4-oxadiazole

Systemtic Name: 3-(3,4-dimethoxyphenyl)-5-(quinolin-2-ylsulfanylmethyl)-1,2,4-oxadiazole Openeye Name: 3-(3,4-dimethoxyphenyl)-5-(2-quinolylsulfanylmethyl)-1,2,4-oxadiazole CAS Name: 3-(3,4-dimethoxyphenyl)-5-[(2-quinolinylthio)methyl]-1,2,4-oxadiazole IUPAC Name: 3-(3,4-dimethoxyphenyl)-5-(quinolin-2-ylsulfanylmethyl)-1,2,4-oxadiazole Traditional Name: 3-(3,4-dimethoxyphenyl)-5-[(2-quinolylthio)methyl]-1,2,4-oxadiazole Formula: C20H17N3O3S MolecularWeight: 379.43228

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NOC(=N2)CSC3=NC4=CC=CC=C4C=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NOC(=N2)CSC3=NC4=CC=CC=C4C=C3)OC

InChI

InChI=1S/C20H17N3O3S/c1-24-16-9-7-14(11-17(16)25-2)20-22-18(26-23-20)12-27-19-10-8-13-5-3-4-6-15(13)21-19/h3-11H,12H2,1-2H3