4-methylbenzenesulfonate; 1,1,4-trimethyl-4-[2-[(1,4,4-trimethyl-2,3,5,6-tetrahydropyrazin-1-yl)methylsulfanyl]ethyl]-2,3,5,6-tetrahydropyrazine

Molecular Formula: C45H68N4O12S5


InChI: InChI=1/C17H40N4S.4C7H8O3S/c1-18(2)7-11-20(5,12-8-18)15-16-22-17-21(6)13-9-19(3,4)10-14-21;4*1-6-2-4-7(5-3-6)11(8,9)10/h7-17H2,1-6H3;4*2-5H,1H3,(H,8,9,10)/q+4;;;;/p-4/fC17H40N4S.4C7H7O3S/qm;4*-1

InChIKey: InChIKey=YYGMDMFGGCXPCV-BKYXEWMPCB
SMILES: CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-].C[N+]1(CC[N+](CC1)(C)CCSC[N+]2(CC[N+](CC2)(C)C)C)C

Names:
    4-methylbenzenesulfonate; 1,1,4-trimethyl-4-[2-[(1,4,4-trimethyl-2,3,5,6-tetrahydropyrazin-1-yl)methylsulfanyl]ethyl]-2,3,5,6-tetrahydropyrazine

Registries:
    PubChem CID 115976
    PubChem ID 10236979