[5-[(4-ethoxyphenyl)methyl]-2-methylsulfanyl-pyrimidin-4-yl]-methyl-azanium

Systemtic Name: [5-[(4-ethoxyphenyl)methyl]-2-methylsulfanyl-pyrimidin-4-yl]-methyl-azanium Openeye Name: [5-[(4-ethoxyphenyl)methyl]-2-methylsulfanyl-pyrimidin-4-yl]-methyl-ammonium CAS Name: [5-[(4-ethoxyphenyl)methyl]-2-(methylthio)-4-pyrimidinyl]-methylammonium IUPAC Name: [5-[(4-ethoxyphenyl)methyl]-2-methylsulfanylpyrimidin-4-yl]-methylazanium Traditional Name: [5-(4-ethoxybenzyl)-2-(methylthio)pyrimidin-4-yl]-methyl-ammonium Formula: C15H20N3OS+ MolecularWeight: 290.4038

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CC2=CN=C(N=C2[NH2+]C)SC

Isomeric SMILES

CCOC1=CC=C(C=C1)CC2=CN=C(N=C2[NH2+]C)SC

InChI

InChI=1S/C15H19N3OS/c1-4-19-13-7-5-11(6-8-13)9-12-10-17-15(20-3)18-14(12)16-2/h5-8,10H,4,9H2,1-3H3,(H,16,17,18)/p+1