2-(4-phenoxybutylsulfanyl)-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazole

Systemtic Name: 2-(4-phenoxybutylsulfanyl)-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazole Openeye Name: 2-(4-phenoxybutylsulfanyl)-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazole CAS Name: 2-(4-phenoxybutylthio)-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazole IUPAC Name: 2-(4-phenoxybutylsulfanyl)-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazole Traditional Name: 2-(4-phenoxybutylthio)-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazole Formula: C21H24N2O5S MolecularWeight: 416.49066

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=NN=C(O2)SCCCCOC3=CC=CC=C3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=NN=C(O2)SCCCCOC3=CC=CC=C3

InChI

InChI=1S/C21H24N2O5S/c1-24-17-13-15(14-18(25-2)19(17)26-3)20-22-23-21(28-20)29-12-8-7-11-27-16-9-5-4-6-10-16/h4-6,9-10,13-14H,7-8,11-12H2,1-3H3