1-[5-[3-fluoranyl-5-(4-methoxyoxan-4-yl)phenyl]sulfanylpyridin-2-yl]-1,3,3-trimethyl-urea

Systemtic Name: 1-[5-[3-fluoranyl-5-(4-methoxyoxan-4-yl)phenyl]sulfanylpyridin-2-yl]-1,3,3-trimethyl-urea Openeye Name: 1-[5-[3-fluoro-5-(4-methoxytetrahydropyran-4-yl)phenyl]sulfanyl-2-pyridyl]-1,3,3-trimethyl-urea CAS Name: 1-[5-[[3-fluoro-5-(4-methoxy-4-oxanyl)phenyl]thio]-2-pyridinyl]-1,3,3-trimethylurea IUPAC Name: 1-[5-[3-fluoro-5-(4-methoxyoxan-4-yl)phenyl]sulfanylpyridin-2-yl]-1,3,3-trimethylurea Traditional Name: 1-[5-[[3-fluoro-5-(4-methoxytetrahydropyran-4-yl)phenyl]thio]-2-pyridyl]-1,3,3-trimethyl-urea Formula: C21H26FN3O3S MolecularWeight: 419.512843

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)N(C)C1=NC=C(C=C1)SC2=CC(=CC(=C2)F)C3(CCOCC3)OC

Isomeric SMILES

CN(C)C(=O)N(C)C1=NC=C(C=C1)SC2=CC(=CC(=C2)F)C3(CCOCC3)OC

InChI

InChI=1S/C21H26FN3O3S/c1-24(2)20(26)25(3)19-6-5-17(14-23-19)29-18-12-15(11-16(22)13-18)21(27-4)7-9-28-10-8-21/h5-6,11-14H,7-10H2,1-4H3