2-(naphthalen-1-ylmethylsulfanyl)-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazole

Systemtic Name: 2-(naphthalen-1-ylmethylsulfanyl)-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazole Openeye Name: 2-(1-naphthylmethylsulfanyl)-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazole CAS Name: 2-(1-naphthalenylmethylthio)-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazole IUPAC Name: 2-(naphthalen-1-ylmethylsulfanyl)-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazole Traditional Name: 2-(1-naphthylmethylthio)-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazole Formula: C22H20N2O4S MolecularWeight: 408.4702

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=NN=C(O2)SCC3=CC=CC4=CC=CC=C43

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=NN=C(O2)SCC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C22H20N2O4S/c1-25-18-11-16(12-19(26-2)20(18)27-3)21-23-24-22(28-21)29-13-15-9-6-8-14-7-4-5-10-17(14)15/h4-12H,13H2,1-3H3