N,N-dimethyl-1,2,3-trithian-5-amine; ethanedioic acid; (oxidanylsulfonothioylamino)cyclohexane

Systemtic Name: N,N-dimethyl-1,2,3-trithian-5-amine; ethanedioic acid; (oxidanylsulfonothioylamino)cyclohexane Openeye Name: N,N-dimethyltrithian-5-amine; (hydroxysulfonothioylamino)cyclohexane; oxalic acid CAS Name: N,N-dimethyl-5-trithianamine; (hydroxysulfonothioylamino)cyclohexane; oxalic acid IUPAC Name: N,N-dimethyltrithian-5-amine; (hydroxysulfonothioylamino)cyclohexane; oxalic acid Traditional Name: dimethyl(trithian-5-yl)amine; (hydroxysulfonothioylamino)cyclohexane; oxalic acid Formula: C13H26N2O6S5 MolecularWeight: 466.68034

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1CSSSC1.C1CCC(CC1)NS(=O)(=S)O.C(=O)(C(=O)O)O

Isomeric SMILES

CN(C)C1CSSSC1.C1CCC(CC1)NS(=O)(=S)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C6H13NO2S2.C5H11NS3.C2H2O4/c8-11(9,10)7-6-4-2-1-3-5-6;1-6(2)5-3-7-9-8-4-5;3-1(4)2(5)6/h6-7H,1-5H2,(H,8,9,10);5H,3-4H2,1-2H3;(H,3,4)(H,5,6)