2-[(3,4-dimethylphenyl)methylsulfanyl]-1-methyl-pyridin-1-ium

Systemtic Name: 2-[(3,4-dimethylphenyl)methylsulfanyl]-1-methyl-pyridin-1-ium Openeye Name: 2-[(3,4-dimethylphenyl)methylsulfanyl]-1-methyl-pyridin-1-ium CAS Name: 2-[(3,4-dimethylphenyl)methylthio]-1-methylpyridin-1-ium IUPAC Name: 2-[(3,4-dimethylphenyl)methylsulfanyl]-1-methylpyridin-1-ium Traditional Name: 2-[(3,4-dimethylbenzyl)thio]-1-methyl-pyridin-1-ium Formula: C15H18NS+ MolecularWeight: 244.37512

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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