3,4,5-trimethoxy-N-phenethyl-benzenecarbothioamide

Systemtic Name: 3,4,5-trimethoxy-N-phenethyl-benzenecarbothioamide Openeye Name: 3,4,5-trimethoxy-N-phenethyl-benzenecarbothioamide CAS Name: 3,4,5-trimethoxy-N-phenethylbenzenecarbothioamide IUPAC Name: 3,4,5-trimethoxy-N-phenethylbenzenecarbothioamide Traditional Name: 3,4,5-trimethoxy-N-phenethyl-thiobenzamide Formula: C18H21NO3S MolecularWeight: 331.42924

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=S)NCCC2=CC=CC=C2

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=S)NCCC2=CC=CC=C2

InChI

InChI=1S/C18H21NO3S/c1-20-15-11-14(12-16(21-2)17(15)22-3)18(23)19-10-9-13-7-5-4-6-8-13/h4-8,11-12H,9-10H2,1-3H3,(H,19,23)