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1-methyl-2-[2-(4-propan-2-ylphenyl)sulfanylethyl]pyridin-1-ium

1-methyl-2-[2-(4-propan-2-ylphenyl)sulfanylethyl]pyridin-1-ium

Systemtic Name:1-methyl-2-[2-(4-propan-2-ylphenyl)sulfanylethyl]pyridin-1-ium
Openeye Name:2-[2-(4-isopropylphenyl)sulfanylethyl]-1-methyl-pyridin-1-ium
CAS Name:1-methyl-2-[2-[(4-propan-2-ylphenyl)thio]ethyl]pyridin-1-ium
IUPAC Name:1-methyl-2-[2-(4-propan-2-ylphenyl)sulfanylethyl]pyridin-1-ium
Traditional Name:1-methyl-2-[2-(p-cumenylthio)ethyl]pyridin-1-ium
Formula: C17H22NS+
MolecularWeight: 272.42828
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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)SCCC2=CC=CC=[N+]2C


Isomeric SMILES

CC(C)C1=CC=C(C=C1)SCCC2=CC=CC=[N+]2C


InChI

InChI=1S/C17H22NS/c1-14(2)15-7-9-17(10-8-15)19-13-11-16-6-4-5-12-18(16)3/h4-10,12,14H,11,13H2,1-3H3/q+1


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