2-[4-[(E)-2-(4-bromophenyl)ethenyl]phenoxy]-N-(1-methyl-2-oxidanylidene-pyrimidin-4-yl)ethanamide

Systemtic Name: 2-[4-[(E)-2-(4-bromophenyl)ethenyl]phenoxy]-N-(1-methyl-2-oxidanylidene-pyrimidin-4-yl)ethanamide Openeye Name: 2-[4-[(E)-2-(4-bromophenyl)vinyl]phenoxy]-N-(1-methyl-2-oxo-pyrimidin-4-yl)acetamide CAS Name: 2-[4-[(E)-2-(4-bromophenyl)ethenyl]phenoxy]-N-(1-methyl-2-oxo-4-pyrimidinyl)acetamide IUPAC Name: 2-[4-[(E)-2-(4-bromophenyl)ethenyl]phenoxy]-N-(1-methyl-2-oxopyrimidin-4-yl)acetamide Traditional Name: 2-[4-[(E)-2-(4-bromophenyl)vinyl]phenoxy]-N-(2-keto-1-methyl-pyrimidin-4-yl)acetamide Formula: C21H18BrN3O3 MolecularWeight: 440.28992

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=NC1=O)NC(=O)COC2=CC=C(C=C2)C=CC3=CC=C(C=C3)Br

Isomeric SMILES

CN1C=CC(=NC1=O)NC(=O)COC2=CC=C(C=C2)/C=C/C3=CC=C(C=C3)Br

InChI

InChI=1S/C21H18BrN3O3/c1-25-13-12-19(24-21(25)27)23-20(26)14-28-18-10-6-16(7-11-18)3-2-15-4-8-17(22)9-5-15/h2-13H,14H2,1H3,(H,23,24,26,27)/b3-2+