3-(1,3-benzodioxol-5-yl)-4-(2,1,3-benzothiadiazol-5-ylmethyl)-5-(4-tert-butylphenyl)-5-oxidanyl-furan-2-one

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-4-(2,1,3-benzothiadiazol-5-ylmethyl)-5-(4-tert-butylphenyl)-5-oxidanyl-furan-2-one Openeye Name: 3-(1,3-benzodioxol-5-yl)-4-(2,1,3-benzothiadiazol-5-ylmethyl)-5-(4-tert-butylphenyl)-5-hydroxy-furan-2-one CAS Name: 3-(1,3-benzodioxol-5-yl)-4-(2,1,3-benzothiadiazol-5-ylmethyl)-5-(4-tert-butylphenyl)-5-hydroxy-2-furanone IUPAC Name: 3-(1,3-benzodioxol-5-yl)-4-(2,1,3-benzothiadiazol-5-ylmethyl)-5-(4-tert-butylphenyl)-5-hydroxyfuran-2-one Traditional Name: 3-(1,3-benzodioxol-5-yl)-5-(4-tert-butylphenyl)-5-hydroxy-4-(piazthiol-5-ylmethyl)furan-2-one Formula: C28H24N2O5S MolecularWeight: 500.56556

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2(C(=C(C(=O)O2)C3=CC4=C(C=C3)OCO4)CC5=CC6=NSN=C6C=C5)O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2(C(=C(C(=O)O2)C3=CC4=C(C=C3)OCO4)CC5=CC6=NSN=C6C=C5)O

InChI

InChI=1S/C28H24N2O5S/c1-27(2,3)18-6-8-19(9-7-18)28(32)20(12-16-4-10-21-22(13-16)30-36-29-21)25(26(31)35-28)17-5-11-23-24(14-17)34-15-33-23/h4-11,13-14,32H,12,15H2,1-3H3