3-[[5-(1,3-benzodioxol-5-yl)-1,3,4-oxadiazol-2-yl]sulfanyl]propanenitrile

Systemtic Name: 3-[[5-(1,3-benzodioxol-5-yl)-1,3,4-oxadiazol-2-yl]sulfanyl]propanenitrile Openeye Name: 3-[[5-(1,3-benzodioxol-5-yl)-1,3,4-oxadiazol-2-yl]sulfanyl]propanenitrile CAS Name: 3-[[5-(1,3-benzodioxol-5-yl)-1,3,4-oxadiazol-2-yl]thio]propanenitrile IUPAC Name: 3-[[5-(1,3-benzodioxol-5-yl)-1,3,4-oxadiazol-2-yl]sulfanyl]propanenitrile Traditional Name: 3-[[5-(1,3-benzodioxol-5-yl)-1,3,4-oxadiazol-2-yl]thio]propionitrile Formula: C12H9N3O3S MolecularWeight: 275.28316

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=NN=C(O3)SCCC#N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=NN=C(O3)SCCC#N

InChI

InChI=1S/C12H9N3O3S/c13-4-1-5-19-12-15-14-11(18-12)8-2-3-9-10(6-8)17-7-16-9/h2-3,6H,1,5,7H2