cyano N'-phenyl-N-pyridin-1-ium-1-yl-carbamimidothioate

Systemtic Name: cyano N'-phenyl-N-pyridin-1-ium-1-yl-carbamimidothioate Openeye Name: (N'-phenyl-N-pyridin-1-ium-1-yl-carbamimidoyl) thiocyanate CAS Name: N'-phenyl-N-(1-pyridin-1-iumyl)carbamimidothioic acid cyano ester IUPAC Name: cyano N'-phenyl-N-pyridin-1-ium-1-ylcarbamimidothioate Traditional Name: thiocyanic acid (N'-phenyl-N-pyridin-1-ium-1-yl-amidino) ester Formula: C13H11N4S+ MolecularWeight: 255.31824

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N=C(N[N+]2=CC=CC=C2)SC#N

Isomeric SMILES

C1=CC=C(C=C1)N=C(N[N+]2=CC=CC=C2)SC#N

InChI

InChI=1S/C13H11N4S/c14-11-18-13(15-12-7-3-1-4-8-12)16-17-9-5-2-6-10-17/h1-10H,(H,15,16)/q+1