N-(4-bromanyl-2-fluoranyl-phenyl)-2-[(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)sulfanyl]propanamide

Systemtic Name: N-(4-bromanyl-2-fluoranyl-phenyl)-2-[(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)sulfanyl]propanamide Openeye Name: N-(4-bromo-2-fluoro-phenyl)-2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)sulfanyl]propanamide CAS Name: N-(4-bromo-2-fluorophenyl)-2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)thio]propanamide IUPAC Name: N-(4-bromo-2-fluorophenyl)-2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)sulfanyl]propanamide Traditional Name: N-(4-bromo-2-fluoro-phenyl)-2-[(4-keto-6-propyl-1H-pyrimidin-2-yl)thio]propionamide Formula: C16H17BrFN3O2S MolecularWeight: 414.292483

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)SC(C)C(=O)NC2=C(C=C(C=C2)Br)F

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)SC(C)C(=O)NC2=C(C=C(C=C2)Br)F

InChI

InChI=1S/C16H17BrFN3O2S/c1-3-4-11-8-14(22)21-16(19-11)24-9(2)15(23)20-13-6-5-10(17)7-12(13)18/h5-9H,3-4H2,1-2H3,(H,20,23)(H,19,21,22)