N-dodecyl-2-pyrimidin-2-ylsulfanyl-ethanamide

Systemtic Name: N-dodecyl-2-pyrimidin-2-ylsulfanyl-ethanamide Openeye Name: N-dodecyl-2-pyrimidin-2-ylsulfanyl-acetamide CAS Name: N-dodecyl-2-(2-pyrimidinylthio)acetamide IUPAC Name: N-dodecyl-2-pyrimidin-2-ylsulfanylacetamide Traditional Name: N-lauryl-2-(2-pyrimidylthio)acetamide Formula: C18H31N3OS MolecularWeight: 337.52324

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCNC(=O)CSC1=NC=CC=N1

Isomeric SMILES

CCCCCCCCCCCCNC(=O)CSC1=NC=CC=N1

InChI

InChI=1S/C18H31N3OS/c1-2-3-4-5-6-7-8-9-10-11-13-19-17(22)16-23-18-20-14-12-15-21-18/h12,14-15H,2-11,13,16H2,1H3,(H,19,22)