5-[5-(2,5-dimethylphenyl)pent-4-ynyl]-5-(4-methoxyphenyl)sulfonyl-1,3-thiazolidine-2,4-dione

Systemtic Name: 5-[5-(2,5-dimethylphenyl)pent-4-ynyl]-5-(4-methoxyphenyl)sulfonyl-1,3-thiazolidine-2,4-dione Openeye Name: 5-[5-(2,5-dimethylphenyl)pent-4-ynyl]-5-(4-methoxyphenyl)sulfonyl-thiazolidine-2,4-dione CAS Name: 5-[5-(2,5-dimethylphenyl)pent-4-ynyl]-5-(4-methoxyphenyl)sulfonylthiazolidine-2,4-dione IUPAC Name: 5-[5-(2,5-dimethylphenyl)pent-4-ynyl]-5-(4-methoxyphenyl)sulfonyl-1,3-thiazolidine-2,4-dione Traditional Name: 5-[5-(2,5-dimethylphenyl)pent-4-ynyl]-5-(4-methoxyphenyl)sulfonyl-thiazolidine-2,4-quinone Formula: C23H23NO5S2 MolecularWeight: 457.56242

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C#CCCCC2(C(=O)NC(=O)S2)S(=O)(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=CC(=C(C=C1)C)C#CCCCC2(C(=O)NC(=O)S2)S(=O)(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C23H23NO5S2/c1-16-8-9-17(2)18(15-16)7-5-4-6-14-23(21(25)24-22(26)30-23)31(27,28)20-12-10-19(29-3)11-13-20/h8-13,15H,4,6,14H2,1-3H3,(H,24,25,26)