furan-2-ylmethyl-[(2-propylsulfanylpyrimidin-5-yl)methyl]-(pyridin-3-ylmethyl)azanium

Systemtic Name: furan-2-ylmethyl-[(2-propylsulfanylpyrimidin-5-yl)methyl]-(pyridin-3-ylmethyl)azanium Openeye Name: 2-furylmethyl-[(2-propylsulfanylpyrimidin-5-yl)methyl]-(3-pyridylmethyl)ammonium CAS Name: 2-furanylmethyl-[[2-(propylthio)-5-pyrimidinyl]methyl]-(3-pyridinylmethyl)ammonium IUPAC Name: furan-2-ylmethyl-[(2-propylsulfanylpyrimidin-5-yl)methyl]-(pyridin-3-ylmethyl)azanium Traditional Name: 2-furfuryl-[[2-(propylthio)pyrimidin-5-yl]methyl]-(3-pyridylmethyl)ammonium Formula: C19H23N4OS+ MolecularWeight: 355.47712

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NC=C(C=N1)C[NH+](CC2=CN=CC=C2)CC3=CC=CO3

Isomeric SMILES

CCCSC1=NC=C(C=N1)C[NH+](CC2=CN=CC=C2)CC3=CC=CO3

InChI

InChI=1S/C19H22N4OS/c1-2-9-25-19-21-11-17(12-22-19)14-23(15-18-6-4-8-24-18)13-16-5-3-7-20-10-16/h3-8,10-12H,2,9,13-15H2,1H3/p+1