N-[(5-bromanyl-2-fluoranyl-phenyl)methyl]-3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)propanamide

Systemtic Name: N-[(5-bromanyl-2-fluoranyl-phenyl)methyl]-3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)propanamide Openeye Name: N-[(5-bromo-2-fluoro-phenyl)methyl]-3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)propanamide CAS Name: N-[(5-bromo-2-fluorophenyl)methyl]-3-[4,6-dimethyl-2-(methylthio)-5-pyrimidinyl]propanamide IUPAC Name: N-[(5-bromo-2-fluorophenyl)methyl]-3-(4,6-dimethyl-2-methylsulfanylpyrimidin-5-yl)propanamide Traditional Name: N-(5-bromo-2-fluoro-benzyl)-3-[4,6-dimethyl-2-(methylthio)pyrimidin-5-yl]propionamide Formula: C17H19BrFN3OS MolecularWeight: 412.319663

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)SC)C)CCC(=O)NCC2=C(C=CC(=C2)Br)F

Isomeric SMILES

CC1=C(C(=NC(=N1)SC)C)CCC(=O)NCC2=C(C=CC(=C2)Br)F

InChI

InChI=1S/C17H19BrFN3OS/c1-10-14(11(2)22-17(21-10)24-3)5-7-16(23)20-9-12-8-13(18)4-6-15(12)19/h4,6,8H,5,7,9H2,1-3H3,(H,20,23)