5-[5-(4-tert-butylphenyl)pent-4-ynyl]-5-(4-methylphenyl)sulfonyl-1,3-thiazolidine-2,4-dione

Systemtic Name: 5-[5-(4-tert-butylphenyl)pent-4-ynyl]-5-(4-methylphenyl)sulfonyl-1,3-thiazolidine-2,4-dione Openeye Name: 5-[5-(4-tert-butylphenyl)pent-4-ynyl]-5-(p-tolylsulfonyl)thiazolidine-2,4-dione CAS Name: 5-[5-(4-tert-butylphenyl)pent-4-ynyl]-5-(4-methylphenyl)sulfonylthiazolidine-2,4-dione IUPAC Name: 5-[5-(4-tert-butylphenyl)pent-4-ynyl]-5-(4-methylphenyl)sulfonyl-1,3-thiazolidine-2,4-dione Traditional Name: 5-[5-(4-tert-butylphenyl)pent-4-ynyl]-5-tosyl-thiazolidine-2,4-quinone Formula: C25H27NO4S2 MolecularWeight: 469.61618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2(C(=O)NC(=O)S2)CCCC#CC3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2(C(=O)NC(=O)S2)CCCC#CC3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C25H27NO4S2/c1-18-9-15-21(16-10-18)32(29,30)25(22(27)26-23(28)31-25)17-7-5-6-8-19-11-13-20(14-12-19)24(2,3)4/h9-16H,5,7,17H2,1-4H3,(H,26,27,28)