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(3-chlorophenyl)methyl-(3-pyrimidin-2-ylsulfanylpropyl)azanium

(3-chlorophenyl)methyl-(3-pyrimidin-2-ylsulfanylpropyl)azanium

Systemtic Name:(3-chlorophenyl)methyl-(3-pyrimidin-2-ylsulfanylpropyl)azanium
Openeye Name:(3-chlorophenyl)methyl-(3-pyrimidin-2-ylsulfanylpropyl)ammonium
CAS Name:(3-chlorophenyl)methyl-[3-(2-pyrimidinylthio)propyl]ammonium
IUPAC Name:(3-chlorophenyl)methyl-(3-pyrimidin-2-ylsulfanylpropyl)azanium
Traditional Name:(3-chlorobenzyl)-[3-(2-pyrimidylthio)propyl]ammonium
Formula: C14H17ClN3S+
MolecularWeight: 294.82288
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)C[NH2+]CCCSC2=NC=CC=N2


Isomeric SMILES

C1=CC(=CC(=C1)Cl)C[NH2+]CCCSC2=NC=CC=N2


InChI

InChI=1S/C14H16ClN3S/c15-13-5-1-4-12(10-13)11-16-6-3-9-19-14-17-7-2-8-18-14/h1-2,4-5,7-8,10,16H,3,6,9,11H2/p+1


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