S-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl] N-pyridin-1-ium-1-ylcarbamothioate

Systemtic Name: S-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl] N-pyridin-1-ium-1-ylcarbamothioate Openeye Name: S-[2-(4-chlorophenyl)-2-oxo-ethyl] N-pyridin-1-ium-1-ylcarbamothioate CAS Name: N-(1-pyridin-1-iumyl)carbamothioic acid S-[2-(4-chlorophenyl)-2-oxoethyl] ester IUPAC Name: S-[2-(4-chlorophenyl)-2-oxoethyl] N-pyridin-1-ium-1-ylcarbamothioate Traditional Name: N-pyridin-1-ium-1-ylthiocarbamic acid S-[2-(4-chlorophenyl)-2-keto-ethyl] ester Formula: C14H12ClN2O2S+ MolecularWeight: 307.77528

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+](C=C1)NC(=O)SCC(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

C1=CC=[N+](C=C1)NC(=O)SCC(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C14H11ClN2O2S/c15-12-6-4-11(5-7-12)13(18)10-20-14(19)16-17-8-2-1-3-9-17/h1-9H,10H2/p+1