S-[(4-chlorophenyl)methyl] N,N-diethylcarbamothioate

Systemtic Name: S-[(4-chlorophenyl)methyl] N,N-diethylcarbamothioate Openeye Name: S-[(4-chlorophenyl)methyl] N,N-diethylcarbamothioate CAS Name: N,N-diethylcarbamothioic acid S-[(4-chlorophenyl)methyl] ester IUPAC Name: S-[(4-chlorophenyl)methyl] N,N-diethylcarbamothioate Traditional Name: N,N-diethylthiocarbamic acid S-(4-chlorobenzyl) ester Formula: C12H16ClNOS MolecularWeight: 257.77954

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)SCC1=CC=C(C=C1)Cl

Isomeric SMILES

CCN(CC)C(=O)SCC1=CC=C(C=C1)Cl

InChI

InChI=1S/C12H16ClNOS/c1-3-14(4-2)12(15)16-9-10-5-7-11(13)8-6-10/h5-8H,3-4,9H2,1-2H3