(2-ethylsulfanylpyrimidin-5-yl)methyl-[(4-methoxyphenyl)methyl]-[[(2R)-oxolan-2-yl]methyl]azanium

Systemtic Name: (2-ethylsulfanylpyrimidin-5-yl)methyl-[(4-methoxyphenyl)methyl]-[[(2R)-oxolan-2-yl]methyl]azanium Openeye Name: (2-ethylsulfanylpyrimidin-5-yl)methyl-[(4-methoxyphenyl)methyl]-[[(2R)-tetrahydrofuran-2-yl]methyl]ammonium CAS Name: [2-(ethylthio)-5-pyrimidinyl]methyl-[(4-methoxyphenyl)methyl]-[[(2R)-2-oxolanyl]methyl]ammonium IUPAC Name: (2-ethylsulfanylpyrimidin-5-yl)methyl-[(4-methoxyphenyl)methyl]-[[(2R)-oxolan-2-yl]methyl]azanium Traditional Name: [2-(ethylthio)pyrimidin-5-yl]methyl-p-anisyl-[[(2R)-tetrahydrofuran-2-yl]methyl]ammonium Formula: C20H28N3O2S+ MolecularWeight: 374.52022

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC=C(C=N1)C[NH+](CC2CCCO2)CC3=CC=C(C=C3)OC

Isomeric SMILES

CCSC1=NC=C(C=N1)C[NH+](C[C@H]2CCCO2)CC3=CC=C(C=C3)OC

InChI

InChI=1S/C20H27N3O2S/c1-3-26-20-21-11-17(12-22-20)14-23(15-19-5-4-10-25-19)13-16-6-8-18(24-2)9-7-16/h6-9,11-12,19H,3-5,10,13-15H2,1-2H3/p+1/t19-/m1/s1