3-(2,1,3-benzothiadiazol-5-yl)-4-[(4-tert-butylphenyl)methyl]-5-oxidanyl-5-(4-propan-2-yloxyphenyl)furan-2-one

Systemtic Name: 3-(2,1,3-benzothiadiazol-5-yl)-4-[(4-tert-butylphenyl)methyl]-5-oxidanyl-5-(4-propan-2-yloxyphenyl)furan-2-one Openeye Name: 3-(2,1,3-benzothiadiazol-5-yl)-4-[(4-tert-butylphenyl)methyl]-5-hydroxy-5-(4-isopropoxyphenyl)furan-2-one CAS Name: 3-(2,1,3-benzothiadiazol-5-yl)-4-[(4-tert-butylphenyl)methyl]-5-hydroxy-5-(4-propan-2-yloxyphenyl)-2-furanone IUPAC Name: 3-(2,1,3-benzothiadiazol-5-yl)-4-[(4-tert-butylphenyl)methyl]-5-hydroxy-5-(4-propan-2-yloxyphenyl)furan-2-one Traditional Name: 4-(4-tert-butylbenzyl)-5-hydroxy-5-(4-isopropoxyphenyl)-3-piazthiol-5-yl-furan-2-one Formula: C30H30N2O4S MolecularWeight: 514.6352

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)C2(C(=C(C(=O)O2)C3=CC4=NSN=C4C=C3)CC5=CC=C(C=C5)C(C)(C)C)O

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)C2(C(=C(C(=O)O2)C3=CC4=NSN=C4C=C3)CC5=CC=C(C=C5)C(C)(C)C)O

InChI

InChI=1S/C30H30N2O4S/c1-18(2)35-23-13-11-22(12-14-23)30(34)24(16-19-6-9-21(10-7-19)29(3,4)5)27(28(33)36-30)20-8-15-25-26(17-20)32-37-31-25/h6-15,17-18,34H,16H2,1-5H3