cyano N'-(4-methoxyphenyl)-N-pyridin-1-ium-1-yl-carbamimidothioate

Systemtic Name: cyano N'-(4-methoxyphenyl)-N-pyridin-1-ium-1-yl-carbamimidothioate Openeye Name: [N'-(4-methoxyphenyl)-N-pyridin-1-ium-1-yl-carbamimidoyl] thiocyanate CAS Name: N'-(4-methoxyphenyl)-N-(1-pyridin-1-iumyl)carbamimidothioic acid cyano ester IUPAC Name: cyano N'-(4-methoxyphenyl)-N-pyridin-1-ium-1-ylcarbamimidothioate Traditional Name: thiocyanic acid [N'-(4-methoxyphenyl)-N-pyridin-1-ium-1-yl-amidino] ester Formula: C14H13N4OS+ MolecularWeight: 285.34422

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N=C(N[N+]2=CC=CC=C2)SC#N

Isomeric SMILES

COC1=CC=C(C=C1)N=C(N[N+]2=CC=CC=C2)SC#N

InChI

InChI=1S/C14H13N4OS/c1-19-13-7-5-12(6-8-13)16-14(20-11-15)17-18-9-3-2-4-10-18/h2-10H,1H3,(H,16,17)/q+1