2-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-(pyridin-3-ylmethylsulfanyl)-1,3,4-oxadiazole

Systemtic Name: 2-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-(pyridin-3-ylmethylsulfanyl)-1,3,4-oxadiazole Openeye Name: 2-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-(3-pyridylmethylsulfanyl)-1,3,4-oxadiazole CAS Name: 2-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-(3-pyridinylmethylthio)-1,3,4-oxadiazole IUPAC Name: 2-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-(pyridin-3-ylmethylsulfanyl)-1,3,4-oxadiazole Traditional Name: 2-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-(3-pyridylmethylthio)-1,3,4-oxadiazole Formula: C16H13N3O3S MolecularWeight: 327.35772

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)C3=NN=C(O3)SCC4=CN=CC=C4

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)C3=NN=C(O3)SCC4=CN=CC=C4

InChI

InChI=1S/C16H13N3O3S/c1-2-11(9-17-5-1)10-23-16-19-18-15(22-16)12-3-4-13-14(8-12)21-7-6-20-13/h1-5,8-9H,6-7,10H2