methyl-[[3-[[(2R)-oxolan-2-yl]methyl]-2-propylsulfonyl-imidazol-4-yl]methyl]-(pyrimidin-4-ylmethyl)azanium

Systemtic Name: methyl-[[3-[[(2R)-oxolan-2-yl]methyl]-2-propylsulfonyl-imidazol-4-yl]methyl]-(pyrimidin-4-ylmethyl)azanium Openeye Name: methyl-[[2-propylsulfonyl-3-[[(2R)-tetrahydrofuran-2-yl]methyl]imidazol-4-yl]methyl]-(pyrimidin-4-ylmethyl)ammonium CAS Name: methyl-[[3-[[(2R)-2-oxolanyl]methyl]-2-propylsulfonyl-4-imidazolyl]methyl]-(4-pyrimidinylmethyl)ammonium IUPAC Name: methyl-[[3-[[(2R)-oxolan-2-yl]methyl]-2-propylsulfonylimidazol-4-yl]methyl]-(pyrimidin-4-ylmethyl)azanium Traditional Name: methyl-[[2-propylsulfonyl-3-[[(2R)-tetrahydrofuran-2-yl]methyl]imidazol-4-yl]methyl]-(4-pyrimidylmethyl)ammonium Formula: C18H28N5O3S+ MolecularWeight: 394.51162

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)C1=NC=C(N1CC2CCCO2)C[NH+](C)CC3=NC=NC=C3

Isomeric SMILES

CCCS(=O)(=O)C1=NC=C(N1C[C@H]2CCCO2)C[NH+](C)CC3=NC=NC=C3

InChI

InChI=1S/C18H27N5O3S/c1-3-9-27(24,25)18-20-10-16(23(18)13-17-5-4-8-26-17)12-22(2)11-15-6-7-19-14-21-15/h6-7,10,14,17H,3-5,8-9,11-13H2,1-2H3/p+1/t17-/m1/s1