2-[2-[(4-fluorophenyl)methylsulfanyl]-4-oxidanylidene-1H-pyrimidin-6-yl]-N-methyl-ethanamide

Systemtic Name: 2-[2-[(4-fluorophenyl)methylsulfanyl]-4-oxidanylidene-1H-pyrimidin-6-yl]-N-methyl-ethanamide Openeye Name: 2-[2-[(4-fluorophenyl)methylsulfanyl]-4-oxo-1H-pyrimidin-6-yl]-N-methyl-acetamide CAS Name: 2-[2-[(4-fluorophenyl)methylthio]-4-oxo-1H-pyrimidin-6-yl]-N-methylacetamide IUPAC Name: 2-[2-[(4-fluorophenyl)methylsulfanyl]-4-oxo-1H-pyrimidin-6-yl]-N-methylacetamide Traditional Name: 2-[2-[(4-fluorobenzyl)thio]-4-keto-1H-pyrimidin-6-yl]-N-methyl-acetamide Formula: C14H14FN3O2S MolecularWeight: 307.343263

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)CC1=CC(=O)N=C(N1)SCC2=CC=C(C=C2)F

Isomeric SMILES

CNC(=O)CC1=CC(=O)N=C(N1)SCC2=CC=C(C=C2)F

InChI

InChI=1S/C14H14FN3O2S/c1-16-12(19)6-11-7-13(20)18-14(17-11)21-8-9-2-4-10(15)5-3-9/h2-5,7H,6,8H2,1H3,(H,16,19)(H,17,18,20)