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

Systemtic Name: 3-(2,1,3-benzothiadiazol-5-yl)-4-[(3-methoxyphenyl)methyl]-5-oxidanyl-5-(4-propan-2-yloxyphenyl)furan-2-one Openeye Name: 3-(2,1,3-benzothiadiazol-5-yl)-5-hydroxy-5-(4-isopropoxyphenyl)-4-[(3-methoxyphenyl)methyl]furan-2-one CAS Name: 3-(2,1,3-benzothiadiazol-5-yl)-5-hydroxy-4-[(3-methoxyphenyl)methyl]-5-(4-propan-2-yloxyphenyl)-2-furanone IUPAC Name: 3-(2,1,3-benzothiadiazol-5-yl)-5-hydroxy-4-[(3-methoxyphenyl)methyl]-5-(4-propan-2-yloxyphenyl)furan-2-one Traditional Name: 5-hydroxy-5-(4-isopropoxyphenyl)-4-m-anisyl-3-piazthiol-5-yl-furan-2-one Formula: C27H24N2O5S MolecularWeight: 488.55486

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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(=CC=C5)OC)O

Isomeric SMILES

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

InChI

InChI=1S/C27H24N2O5S/c1-16(2)33-20-10-8-19(9-11-20)27(31)22(14-17-5-4-6-21(13-17)32-3)25(26(30)34-27)18-7-12-23-24(15-18)29-35-28-23/h4-13,15-16,31H,14H2,1-3H3