(5-methylfuran-2-yl)methyl-[(2-methylsulfanylpyrimidin-5-yl)methyl]-(pyridin-2-ylmethyl)azanium

Systemtic Name: (5-methylfuran-2-yl)methyl-[(2-methylsulfanylpyrimidin-5-yl)methyl]-(pyridin-2-ylmethyl)azanium Openeye Name: (5-methyl-2-furyl)methyl-[(2-methylsulfanylpyrimidin-5-yl)methyl]-(2-pyridylmethyl)ammonium CAS Name: (5-methyl-2-furanyl)methyl-[[2-(methylthio)-5-pyrimidinyl]methyl]-(2-pyridinylmethyl)ammonium IUPAC Name: (5-methylfuran-2-yl)methyl-[(2-methylsulfanylpyrimidin-5-yl)methyl]-(pyridin-2-ylmethyl)azanium Traditional Name: (5-methyl-2-furyl)methyl-[[2-(methylthio)pyrimidin-5-yl]methyl]-(2-pyridylmethyl)ammonium Formula: C18H21N4OS+ MolecularWeight: 341.45054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C[NH+](CC2=CC=CC=N2)CC3=CN=C(N=C3)SC

Isomeric SMILES

CC1=CC=C(O1)C[NH+](CC2=CC=CC=N2)CC3=CN=C(N=C3)SC

InChI

InChI=1S/C18H20N4OS/c1-14-6-7-17(23-14)13-22(12-16-5-3-4-8-19-16)11-15-9-20-18(24-2)21-10-15/h3-10H,11-13H2,1-2H3/p+1