3-[4-(diphenylmethyl)piperazin-1-yl]thiolane 1,1-dioxide; ethanedioic acid

Systemtic Name: 3-[4-(diphenylmethyl)piperazin-1-yl]thiolane 1,1-dioxide; ethanedioic acid Openeye Name: 3-(4-benzhydrylpiperazin-1-yl)thiolane 1,1-dioxide; oxalic acid CAS Name: 3-[4-(diphenylmethyl)-1-piperazinyl]thiolane 1,1-dioxide; oxalic acid IUPAC Name: 3-(4-benzhydrylpiperazin-1-yl)thiolane 1,1-dioxide; oxalic acid Traditional Name: 3-(4-benzhydrylpiperazino)sulfolane; oxalic acid Formula: C23H28N2O6S MolecularWeight: 460.54322

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CC1N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4.C(=O)(C(=O)O)O

Isomeric SMILES

C1CS(=O)(=O)CC1N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4.C(=O)(C(=O)O)O

InChI

InChI=1S/C21H26N2O2S.C2H2O4/c24-26(25)16-11-20(17-26)22-12-14-23(15-13-22)21(18-7-3-1-4-8-18)19-9-5-2-6-10-19;3-1(4)2(5)6/h1-10,20-21H,11-17H2;(H,3,4)(H,5,6)