N-(2-methylpyridin-1-ium-1-yl)-N'-phenyl-carbamimidothioate

Systemtic Name: N-(2-methylpyridin-1-ium-1-yl)-N'-phenyl-carbamimidothioate Openeye Name: N-(2-methylpyridin-1-ium-1-yl)-N'-phenyl-carbamimidothioate CAS Name: N-(2-methyl-1-pyridin-1-iumyl)-N'-phenylcarbamimidothioate IUPAC Name: N-(2-methylpyridin-1-ium-1-yl)-N'-phenylcarbamimidothioate Traditional Name: N-(2-methylpyridin-1-ium-1-yl)-N'-phenyl-carbamimidothioate Formula: C13H13N3S MolecularWeight: 243.32742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=[N+]1NC(=NC2=CC=CC=C2)[S-]

Isomeric SMILES

CC1=CC=CC=[N+]1NC(=NC2=CC=CC=C2)[S-]

InChI

InChI=1S/C13H13N3S/c1-11-7-5-6-10-16(11)15-13(17)14-12-8-3-2-4-9-12/h2-10H,1H3,(H-,14,15,17)