2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-[[4-(4-fluoranylphenoxy)phenyl]methyl]ethanamide

Systemtic Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-[[4-(4-fluoranylphenoxy)phenyl]methyl]ethanamide Openeye Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-[[4-(4-fluorophenoxy)phenyl]methyl]acetamide CAS Name: 2-[(4,6-dimethyl-2-pyrimidinyl)thio]-N-[[4-(4-fluorophenoxy)phenyl]methyl]acetamide IUPAC Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-[[4-(4-fluorophenoxy)phenyl]methyl]acetamide Traditional Name: 2-[(4,6-dimethylpyrimidin-2-yl)thio]-N-[4-(4-fluorophenoxy)benzyl]acetamide Formula: C21H20FN3O2S MolecularWeight: 397.465803

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)NCC2=CC=C(C=C2)OC3=CC=C(C=C3)F)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)NCC2=CC=C(C=C2)OC3=CC=C(C=C3)F)C

InChI

InChI=1S/C21H20FN3O2S/c1-14-11-15(2)25-21(24-14)28-13-20(26)23-12-16-3-7-18(8-4-16)27-19-9-5-17(22)6-10-19/h3-11H,12-13H2,1-2H3,(H,23,26)