N-[2-[4-[bis(fluoranyl)methoxy]-3-methoxy-phenyl]ethyl]-2-pyrimidin-2-ylsulfanyl-ethanamide

Systemtic Name: N-[2-[4-[bis(fluoranyl)methoxy]-3-methoxy-phenyl]ethyl]-2-pyrimidin-2-ylsulfanyl-ethanamide Openeye Name: N-[2-[4-(difluoromethoxy)-3-methoxy-phenyl]ethyl]-2-pyrimidin-2-ylsulfanyl-acetamide CAS Name: N-[2-[4-(difluoromethoxy)-3-methoxyphenyl]ethyl]-2-(2-pyrimidinylthio)acetamide IUPAC Name: N-[2-[4-(difluoromethoxy)-3-methoxyphenyl]ethyl]-2-pyrimidin-2-ylsulfanylacetamide Traditional Name: N-[2-[4-(difluoromethoxy)-3-methoxy-phenyl]ethyl]-2-(2-pyrimidylthio)acetamide Formula: C16H17F2N3O3S MolecularWeight: 369.386286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17F2N3O3S/c1-23-13-9-11(3-4-12(13)24-15(17)18)5-8-19-14(22)10-25-16-20-6-2-7-21-16/h2-4,6-7,9,15H,5,8,10H2,1H3,(H,19,22)