(1E)-4-chloranyl-N-pyridin-1-ium-1-yl-benzenecarboximidothioate

Systemtic Name: (1E)-4-chloranyl-N-pyridin-1-ium-1-yl-benzenecarboximidothioate Openeye Name: (1E)-4-chloro-N-pyridin-1-ium-1-yl-benzenecarboximidothioate CAS Name: (1E)-4-chloro-N-(1-pyridin-1-iumyl)benzenecarboximidothioate IUPAC Name: (1E)-4-chloro-N-pyridin-1-ium-1-ylbenzenecarboximidothioate Traditional Name: (1E)-4-chloro-N-pyridin-1-ium-1-yl-benzenecarboximidothioate Formula: C12H9ClN2S MolecularWeight: 248.73126

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H9ClN2S/c13-11-6-4-10(5-7-11)12(16)14-15-8-2-1-3-9-15/h1-9H