(2-ethoxynaphthalen-1-yl)methyl-(3-pyrimidin-2-ylsulfanylpropyl)azanium

Systemtic Name: (2-ethoxynaphthalen-1-yl)methyl-(3-pyrimidin-2-ylsulfanylpropyl)azanium Openeye Name: (2-ethoxy-1-naphthyl)methyl-(3-pyrimidin-2-ylsulfanylpropyl)ammonium CAS Name: (2-ethoxy-1-naphthalenyl)methyl-[3-(2-pyrimidinylthio)propyl]ammonium IUPAC Name: (2-ethoxynaphthalen-1-yl)methyl-(3-pyrimidin-2-ylsulfanylpropyl)azanium Traditional Name: (2-ethoxy-1-naphthyl)methyl-[3-(2-pyrimidylthio)propyl]ammonium Formula: C20H24N3OS+ MolecularWeight: 354.48906

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C2=CC=CC=C2C=C1)C[NH2+]CCCSC3=NC=CC=N3

Isomeric SMILES

CCOC1=C(C2=CC=CC=C2C=C1)C[NH2+]CCCSC3=NC=CC=N3

InChI

InChI=1S/C20H23N3OS/c1-2-24-19-10-9-16-7-3-4-8-17(16)18(19)15-21-11-6-14-25-20-22-12-5-13-23-20/h3-5,7-10,12-13,21H,2,6,11,14-15H2,1H3/p+1