S-[2-(dibutylamino)ethyl] 2-ethylbenzenecarbothioate

Systemtic Name: S-[2-(dibutylamino)ethyl] 2-ethylbenzenecarbothioate Openeye Name: S-[2-(dibutylamino)ethyl] 2-ethylbenzenecarbothioate CAS Name: 2-ethylbenzenecarbothioic acid S-[2-(dibutylamino)ethyl] ester IUPAC Name: S-[2-(dibutylamino)ethyl] 2-ethylbenzenecarbothioate Traditional Name: 2-ethylthiobenzoic acid S-[2-(dibutylamino)ethyl] ester Formula: C19H31NOS MolecularWeight: 321.52054

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)CCSC(=O)C1=CC=CC=C1CC

Isomeric SMILES

CCCCN(CCCC)CCSC(=O)C1=CC=CC=C1CC

InChI

InChI=1S/C19H31NOS/c1-4-7-13-20(14-8-5-2)15-16-22-19(21)18-12-10-9-11-17(18)6-3/h9-12H,4-8,13-16H2,1-3H3