4-[2,2-dimethyl-1-[3-(1,3-thiazol-4-ylsulfonylmethyl)phenyl]propyl]-5-oxidanyl-2,2-dipropyl-furan-3-one

Systemtic Name: 4-[2,2-dimethyl-1-[3-(1,3-thiazol-4-ylsulfonylmethyl)phenyl]propyl]-5-oxidanyl-2,2-dipropyl-furan-3-one Openeye Name: 4-[2,2-dimethyl-1-[3-(thiazol-4-ylsulfonylmethyl)phenyl]propyl]-5-hydroxy-2,2-dipropyl-furan-3-one CAS Name: 4-[2,2-dimethyl-1-[3-(4-thiazolylsulfonylmethyl)phenyl]propyl]-5-hydroxy-2,2-dipropyl-3-furanone IUPAC Name: 4-[2,2-dimethyl-1-[3-(1,3-thiazol-4-ylsulfonylmethyl)phenyl]propyl]-5-hydroxy-2,2-dipropylfuran-3-one Traditional Name: 4-[2,2-dimethyl-1-[3-(thiazol-4-ylsulfonylmethyl)phenyl]propyl]-5-hydroxy-2,2-dipropyl-furan-3-one Formula: C25H33NO5S2 MolecularWeight: 491.66322

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1(C(=O)C(=C(O1)O)C(C2=CC=CC(=C2)CS(=O)(=O)C3=CSC=N3)C(C)(C)C)CCC

Isomeric SMILES

CCCC1(C(=O)C(=C(O1)O)C(C2=CC=CC(=C2)CS(=O)(=O)C3=CSC=N3)C(C)(C)C)CCC

InChI

InChI=1S/C25H33NO5S2/c1-6-11-25(12-7-2)22(27)20(23(28)31-25)21(24(3,4)5)18-10-8-9-17(13-18)15-33(29,30)19-14-32-16-26-19/h8-10,13-14,16,21,28H,6-7,11-12,15H2,1-5H3