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

Systemtic Name: furan-2-ylmethyl-[(2-methylsulfanylpyrimidin-5-yl)methyl]-(pyridin-2-ylmethyl)azanium Openeye Name: 2-furylmethyl-[(2-methylsulfanylpyrimidin-5-yl)methyl]-(2-pyridylmethyl)ammonium CAS Name: 2-furanylmethyl-[[2-(methylthio)-5-pyrimidinyl]methyl]-(2-pyridinylmethyl)ammonium IUPAC Name: furan-2-ylmethyl-[(2-methylsulfanylpyrimidin-5-yl)methyl]-(pyridin-2-ylmethyl)azanium Traditional Name: 2-furfuryl-[[2-(methylthio)pyrimidin-5-yl]methyl]-(2-pyridylmethyl)ammonium Formula: C17H19N4OS+ MolecularWeight: 327.42396

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(C=N1)C[NH+](CC2=CC=CC=N2)CC3=CC=CO3

Isomeric SMILES

CSC1=NC=C(C=N1)C[NH+](CC2=CC=CC=N2)CC3=CC=CO3

InChI

InChI=1S/C17H18N4OS/c1-23-17-19-9-14(10-20-17)11-21(13-16-6-4-8-22-16)12-15-5-2-3-7-18-15/h2-10H,11-13H2,1H3/p+1