N-[2-(3,4-dimethoxyphenyl)ethyl]-2-pyrimidin-2-ylsulfanyl-ethanamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-pyrimidin-2-ylsulfanyl-ethanamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-pyrimidin-2-ylsulfanyl-acetamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(2-pyrimidinylthio)acetamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-pyrimidin-2-ylsulfanylacetamide Traditional Name: N-homoveratryl-2-(2-pyrimidylthio)acetamide Formula: C16H19N3O3S MolecularWeight: 333.40536

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)CSC2=NC=CC=N2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)CSC2=NC=CC=N2)OC

InChI

InChI=1S/C16H19N3O3S/c1-21-13-5-4-12(10-14(13)22-2)6-9-17-15(20)11-23-16-18-7-3-8-19-16/h3-5,7-8,10H,6,9,11H2,1-2H3,(H,17,20)