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1,3-diethyl-2,5,6-trimethyl-2H-imidazo[4,5-b]pyrazin-7-ium; 4-methylbenzenesulfonate

1,3-diethyl-2,5,6-trimethyl-2H-imidazo[4,5-b]pyrazin-7-ium; 4-methylbenzenesulfonate

Systemtic Name:1,3-diethyl-2,5,6-trimethyl-2H-imidazo[4,5-b]pyrazin-7-ium; 4-methylbenzenesulfonate
Openeye Name:1,3-diethyl-2,5,6-trimethyl-2H-imidazo[4,5-b]pyrazin-7-ium; 4-methylbenzenesulfonate
CAS Name:1,3-diethyl-2,5,6-trimethyl-2H-imidazo[4,5-b]pyrazin-7-ium; 4-methylbenzenesulfonate
IUPAC Name:1,3-diethyl-2,5,6-trimethyl-2H-imidazo[4,5-b]pyrazin-7-ium; 4-methylbenzenesulfonate
Traditional Name:1,3-diethyl-2,5,6-trimethyl-2H-imidazo[4,5-b]pyrazin-7-ium tosylate
Formula: C19H28N4O3S
MolecularWeight: 392.51562
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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(N(C2=NC(=C([NH+]=C21)C)C)CC)C.CC1=CC=C(C=C1)S(=O)(=O)[O-]


Isomeric SMILES

CCN1C(N(C2=NC(=C([NH+]=C21)C)C)CC)C.CC1=CC=C(C=C1)S(=O)(=O)[O-]


InChI

InChI=1S/C12H20N4.C7H8O3S/c1-6-15-10(5)16(7-2)12-11(15)13-8(3)9(4)14-12;1-6-2-4-7(5-3-6)11(8,9)10/h10H,6-7H2,1-5H3;2-5H,1H3,(H,8,9,10)


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