(1E)-4-chloranyl-N-(3-methylpyridin-1-ium-1-yl)benzenecarboximidothioate

Systemtic Name: (1E)-4-chloranyl-N-(3-methylpyridin-1-ium-1-yl)benzenecarboximidothioate Openeye Name: (1E)-4-chloro-N-(3-methylpyridin-1-ium-1-yl)benzenecarboximidothioate CAS Name: (1E)-4-chloro-N-(3-methyl-1-pyridin-1-iumyl)benzenecarboximidothioate IUPAC Name: (1E)-4-chloro-N-(3-methylpyridin-1-ium-1-yl)benzenecarboximidothioate Traditional Name: (1E)-4-chloro-N-(3-methylpyridin-1-ium-1-yl)benzenecarboximidothioate Formula: C13H11ClN2S MolecularWeight: 262.75784

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C[N+](=CC=C1)N=C(C2=CC=C(C=C2)Cl)[S-]

Isomeric SMILES

CC1=C[N+](=CC=C1)/N=C(\C2=CC=C(C=C2)Cl)/[S-]

InChI

InChI=1S/C13H11ClN2S/c1-10-3-2-8-16(9-10)15-13(17)11-4-6-12(14)7-5-11/h2-9H,1H3