1,1-bis(oxidanylidene)-4-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]thiolan-3-ol; ethanedioic acid

Systemtic Name: 1,1-bis(oxidanylidene)-4-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]thiolan-3-ol; ethanedioic acid Openeye Name: 4-[4-(4-isopropylphenyl)sulfonylpiperazin-1-yl]-1,1-dioxo-thiolan-3-ol; oxalic acid CAS Name: 1,1-dioxo-4-[4-(4-propan-2-ylphenyl)sulfonyl-1-piperazinyl]-3-thiolanol; oxalic acid IUPAC Name: 1,1-dioxo-4-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]thiolan-3-ol; oxalic acid Traditional Name: 1,1-diketo-4-(4-p-cumenylsulfonylpiperazino)thiolan-3-ol; oxalic acid Formula: C19H28N2O9S2 MolecularWeight: 492.56362

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3CS(=O)(=O)CC3O.C(=O)(C(=O)O)O

Isomeric SMILES

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3CS(=O)(=O)CC3O.C(=O)(C(=O)O)O

InChI

InChI=1S/C17H26N2O5S2.C2H2O4/c1-13(2)14-3-5-15(6-4-14)26(23,24)19-9-7-18(8-10-19)16-11-25(21,22)12-17(16)20;3-1(4)2(5)6/h3-6,13,16-17,20H,7-12H2,1-2H3;(H,3,4)(H,5,6)