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2-[(2,5-dimethylphenyl)methylsulfanyl]-1-methyl-pyridin-1-ium chloride

2-[(2,5-dimethylphenyl)methylsulfanyl]-1-methyl-pyridin-1-ium chloride

Systemtic Name:2-[(2,5-dimethylphenyl)methylsulfanyl]-1-methyl-pyridin-1-ium chloride
Openeye Name:2-[(2,5-dimethylphenyl)methylsulfanyl]-1-methyl-pyridin-1-ium chloride
CAS Name:2-[(2,5-dimethylphenyl)methylthio]-1-methylpyridin-1-ium chloride
IUPAC Name:2-[(2,5-dimethylphenyl)methylsulfanyl]-1-methylpyridin-1-ium chloride
Traditional Name:2-[(2,5-dimethylbenzyl)thio]-1-methyl-pyridin-1-ium chloride
Formula: C15H18ClNS
MolecularWeight: 279.82812
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CSC2=CC=CC=[N+]2C.[Cl-]


Isomeric SMILES

CC1=CC(=C(C=C1)C)CSC2=CC=CC=[N+]2C.[Cl-]


InChI

InChI=1S/C15H18NS.ClH/c1-12-7-8-13(2)14(10-12)11-17-15-6-4-5-9-16(15)3;/h4-10H,11H2,1-3H3;1H/q+1;/p-1


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