2-(3-methylbut-2-enylsulfanyl)-5-(3-piperidin-1-ylsulfonylphenyl)-1,3,4-oxadiazole

Systemtic Name: 2-(3-methylbut-2-enylsulfanyl)-5-(3-piperidin-1-ylsulfonylphenyl)-1,3,4-oxadiazole Openeye Name: 2-(3-methylbut-2-enylsulfanyl)-5-[3-(1-piperidylsulfonyl)phenyl]-1,3,4-oxadiazole CAS Name: 2-(3-methylbut-2-enylthio)-5-[3-(1-piperidinylsulfonyl)phenyl]-1,3,4-oxadiazole IUPAC Name: 2-(3-methylbut-2-enylsulfanyl)-5-(3-piperidin-1-ylsulfonylphenyl)-1,3,4-oxadiazole Traditional Name: 2-(3-methylbut-2-enylthio)-5-(3-piperidinosulfonylphenyl)-1,3,4-oxadiazole Formula: C18H23N3O3S2 MolecularWeight: 393.52352

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCSC1=NN=C(O1)C2=CC(=CC=C2)S(=O)(=O)N3CCCCC3)C

Isomeric SMILES

CC(=CCSC1=NN=C(O1)C2=CC(=CC=C2)S(=O)(=O)N3CCCCC3)C

InChI

InChI=1S/C18H23N3O3S2/c1-14(2)9-12-25-18-20-19-17(24-18)15-7-6-8-16(13-15)26(22,23)21-10-4-3-5-11-21/h6-9,13H,3-5,10-12H2,1-2H3