2-(3,4-dimethoxyphenyl)-5-(pyridin-4-ylmethylsulfanyl)-1,3,4-oxadiazole

Systemtic Name: 2-(3,4-dimethoxyphenyl)-5-(pyridin-4-ylmethylsulfanyl)-1,3,4-oxadiazole Openeye Name: 2-(3,4-dimethoxyphenyl)-5-(4-pyridylmethylsulfanyl)-1,3,4-oxadiazole CAS Name: 2-(3,4-dimethoxyphenyl)-5-(pyridin-4-ylmethylthio)-1,3,4-oxadiazole IUPAC Name: 2-(3,4-dimethoxyphenyl)-5-(pyridin-4-ylmethylsulfanyl)-1,3,4-oxadiazole Traditional Name: 2-(3,4-dimethoxyphenyl)-5-(4-pyridylmethylthio)-1,3,4-oxadiazole Formula: C16H15N3O3S MolecularWeight: 329.3736

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NN=C(O2)SCC3=CC=NC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NN=C(O2)SCC3=CC=NC=C3)OC

InChI

InChI=1S/C16H15N3O3S/c1-20-13-4-3-12(9-14(13)21-2)15-18-19-16(22-15)23-10-11-5-7-17-8-6-11/h3-9H,10H2,1-2H3