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

Systemtic Name: 3-(2,1,3-benzothiadiazol-5-yl)-4-[(4-methoxy-3-methyl-phenyl)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-[(4-methoxy-3-methyl-phenyl)methyl]furan-2-one CAS Name: 3-(2,1,3-benzothiadiazol-5-yl)-5-hydroxy-4-[(4-methoxy-3-methylphenyl)methyl]-5-(4-propan-2-yloxyphenyl)-2-furanone IUPAC Name: 3-(2,1,3-benzothiadiazol-5-yl)-5-hydroxy-4-[(4-methoxy-3-methylphenyl)methyl]-5-(4-propan-2-yloxyphenyl)furan-2-one Traditional Name: 5-hydroxy-5-(4-isopropoxyphenyl)-4-(4-methoxy-3-methyl-benzyl)-3-piazthiol-5-yl-furan-2-one Formula: C28H26N2O5S MolecularWeight: 502.58144

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)CC2=C(C(=O)OC2(C3=CC=C(C=C3)OC(C)C)O)C4=CC5=NSN=C5C=C4)OC

Isomeric SMILES

CC1=C(C=CC(=C1)CC2=C(C(=O)OC2(C3=CC=C(C=C3)OC(C)C)O)C4=CC5=NSN=C5C=C4)OC

InChI

InChI=1S/C28H26N2O5S/c1-16(2)34-21-9-7-20(8-10-21)28(32)22(14-18-5-12-25(33-4)17(3)13-18)26(27(31)35-28)19-6-11-23-24(15-19)30-36-29-23/h5-13,15-16,32H,14H2,1-4H3