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

Systemtic Name: 2-(1,3-benzodioxol-5-ylmethylsulfanyl)-5-(3,5-dimethylphenyl)-1,3,4-oxadiazole Openeye Name: 2-(1,3-benzodioxol-5-ylmethylsulfanyl)-5-(3,5-dimethylphenyl)-1,3,4-oxadiazole CAS Name: 2-(1,3-benzodioxol-5-ylmethylthio)-5-(3,5-dimethylphenyl)-1,3,4-oxadiazole IUPAC Name: 2-(1,3-benzodioxol-5-ylmethylsulfanyl)-5-(3,5-dimethylphenyl)-1,3,4-oxadiazole Traditional Name: 2-(3,5-dimethylphenyl)-5-(piperonylthio)-1,3,4-oxadiazole Formula: C18H16N2O3S MolecularWeight: 340.39624

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C2=NN=C(O2)SCC3=CC4=C(C=C3)OCO4)C

Isomeric SMILES

CC1=CC(=CC(=C1)C2=NN=C(O2)SCC3=CC4=C(C=C3)OCO4)C

InChI

InChI=1S/C18H16N2O3S/c1-11-5-12(2)7-14(6-11)17-19-20-18(23-17)24-9-13-3-4-15-16(8-13)22-10-21-15/h3-8H,9-10H2,1-2H3