2,4,5-trimethoxy-N-phenethyl-benzenecarbothioamide

Systemtic Name: 2,4,5-trimethoxy-N-phenethyl-benzenecarbothioamide Openeye Name: 2,4,5-trimethoxy-N-phenethyl-benzenecarbothioamide CAS Name: 2,4,5-trimethoxy-N-phenethylbenzenecarbothioamide IUPAC Name: 2,4,5-trimethoxy-N-phenethylbenzenecarbothioamide Traditional Name: 2,4,5-trimethoxy-N-phenethyl-thiobenzamide Formula: C18H21NO3S MolecularWeight: 331.42924

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=S)NCCC2=CC=CC=C2)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1C(=S)NCCC2=CC=CC=C2)OC)OC

InChI

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