methyl 4-(2-chlorophenyl)-N-cyano-piperazine-1-carboximidothioate

Systemtic Name: methyl 4-(2-chlorophenyl)-N-cyano-piperazine-1-carboximidothioate Openeye Name: methyl 4-(2-chlorophenyl)-N-cyano-piperazine-1-carboximidothioate CAS Name: 4-(2-chlorophenyl)-N-cyano-1-piperazinecarboximidothioic acid methyl ester IUPAC Name: methyl 4-(2-chlorophenyl)-N-cyanopiperazine-1-carboximidothioate Traditional Name: 4-(2-chlorophenyl)-N-cyano-piperazine-1-carboximidothioic acid methyl ester Formula: C13H15ClN4S MolecularWeight: 294.803

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC(=NC#N)N1CCN(CC1)C2=CC=CC=C2Cl

Isomeric SMILES

CSC(=NC#N)N1CCN(CC1)C2=CC=CC=C2Cl

InChI

InChI=1S/C13H15ClN4S/c1-19-13(16-10-15)18-8-6-17(7-9-18)12-5-3-2-4-11(12)14/h2-5H,6-9H2,1H3