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

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-5-(pyridin-4-ylmethylsulfanyl)-1,3,4-oxadiazole Openeye Name: 2-(1,3-benzodioxol-5-yl)-5-(4-pyridylmethylsulfanyl)-1,3,4-oxadiazole CAS Name: 2-(1,3-benzodioxol-5-yl)-5-(pyridin-4-ylmethylthio)-1,3,4-oxadiazole IUPAC Name: 2-(1,3-benzodioxol-5-yl)-5-(pyridin-4-ylmethylsulfanyl)-1,3,4-oxadiazole Traditional Name: 2-(1,3-benzodioxol-5-yl)-5-(4-pyridylmethylthio)-1,3,4-oxadiazole Formula: C15H11N3O3S MolecularWeight: 313.33114

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=NN=C(O3)SCC4=CC=NC=C4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=NN=C(O3)SCC4=CC=NC=C4

InChI

InChI=1S/C15H11N3O3S/c1-2-12-13(20-9-19-12)7-11(1)14-17-18-15(21-14)22-8-10-3-5-16-6-4-10/h1-7H,8-9H2