4-(3-bromanylphenoxy)-N-[3-(2-methylpyrimidin-4-yl)phenyl]butanamide

Systemtic Name: 4-(3-bromanylphenoxy)-N-[3-(2-methylpyrimidin-4-yl)phenyl]butanamide Openeye Name: 4-(3-bromophenoxy)-N-[3-(2-methylpyrimidin-4-yl)phenyl]butanamide CAS Name: 4-(3-bromophenoxy)-N-[3-(2-methyl-4-pyrimidinyl)phenyl]butanamide IUPAC Name: 4-(3-bromophenoxy)-N-[3-(2-methylpyrimidin-4-yl)phenyl]butanamide Traditional Name: 4-(3-bromophenoxy)-N-[3-(2-methylpyrimidin-4-yl)phenyl]butyramide Formula: C21H20BrN3O2 MolecularWeight: 426.3064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CC(=N1)C2=CC(=CC=C2)NC(=O)CCCOC3=CC(=CC=C3)Br

Isomeric SMILES

CC1=NC=CC(=N1)C2=CC(=CC=C2)NC(=O)CCCOC3=CC(=CC=C3)Br

InChI

InChI=1S/C21H20BrN3O2/c1-15-23-11-10-20(24-15)16-5-2-7-18(13-16)25-21(26)9-4-12-27-19-8-3-6-17(22)14-19/h2-3,5-8,10-11,13-14H,4,9,12H2,1H3,(H,25,26)