3-[[5-(3-morpholin-4-ylsulfonylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]pentane-2,4-dione

Systemtic Name: 3-[[5-(3-morpholin-4-ylsulfonylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]pentane-2,4-dione Openeye Name: 3-[[5-(3-morpholinosulfonylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]pentane-2,4-dione CAS Name: 3-[[5-[3-(4-morpholinylsulfonyl)phenyl]-1,3,4-oxadiazol-2-yl]thio]pentane-2,4-dione IUPAC Name: 3-[[5-(3-morpholin-4-ylsulfonylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]pentane-2,4-dione Traditional Name: 3-[[5-(3-morpholinosulfonylphenyl)-1,3,4-oxadiazol-2-yl]thio]pentane-2,4-dione Formula: C17H19N3O6S2 MolecularWeight: 425.47926

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C(=O)C)SC1=NN=C(O1)C2=CC(=CC=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC(=O)C(C(=O)C)SC1=NN=C(O1)C2=CC(=CC=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C17H19N3O6S2/c1-11(21)15(12(2)22)27-17-19-18-16(26-17)13-4-3-5-14(10-13)28(23,24)20-6-8-25-9-7-20/h3-5,10,15H,6-9H2,1-2H3