3,3-dimethyl-1-[[5-(3-piperidin-1-ylsulfonylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]butan-2-one

Systemtic Name: 3,3-dimethyl-1-[[5-(3-piperidin-1-ylsulfonylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]butan-2-one Openeye Name: 3,3-dimethyl-1-[[5-[3-(1-piperidylsulfonyl)phenyl]-1,3,4-oxadiazol-2-yl]sulfanyl]butan-2-one CAS Name: 3,3-dimethyl-1-[[5-[3-(1-piperidinylsulfonyl)phenyl]-1,3,4-oxadiazol-2-yl]thio]-2-butanone IUPAC Name: 3,3-dimethyl-1-[[5-(3-piperidin-1-ylsulfonylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]butan-2-one Traditional Name: 3,3-dimethyl-1-[[5-(3-piperidinosulfonylphenyl)-1,3,4-oxadiazol-2-yl]thio]butan-2-one Formula: C19H25N3O4S2 MolecularWeight: 423.5495

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)CSC1=NN=C(O1)C2=CC(=CC=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC(C)(C)C(=O)CSC1=NN=C(O1)C2=CC(=CC=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C19H25N3O4S2/c1-19(2,3)16(23)13-27-18-21-20-17(26-18)14-8-7-9-15(12-14)28(24,25)22-10-5-4-6-11-22/h7-9,12H,4-6,10-11,13H2,1-3H3