[2-(4-bromophenyl)-2-oxidanylidene-ethyl]-(4,6-dimethylpyrimidin-2-yl)cyanamide

Systemtic Name: [2-(4-bromophenyl)-2-oxidanylidene-ethyl]-(4,6-dimethylpyrimidin-2-yl)cyanamide Openeye Name: [2-(4-bromophenyl)-2-oxo-ethyl]-(4,6-dimethylpyrimidin-2-yl)cyanamide CAS Name: [2-(4-bromophenyl)-2-oxoethyl]-(4,6-dimethyl-2-pyrimidinyl)cyanamide IUPAC Name: [2-(4-bromophenyl)-2-oxoethyl]-(4,6-dimethylpyrimidin-2-yl)cyanamide Traditional Name: [2-(4-bromophenyl)-2-keto-ethyl]-(4,6-dimethylpyrimidin-2-yl)cyanamide Formula: C15H13BrN4O MolecularWeight: 345.19392

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N(CC(=O)C2=CC=C(C=C2)Br)C#N)C

Isomeric SMILES

CC1=CC(=NC(=N1)N(CC(=O)C2=CC=C(C=C2)Br)C#N)C

InChI

InChI=1S/C15H13BrN4O/c1-10-7-11(2)19-15(18-10)20(9-17)8-14(21)12-3-5-13(16)6-4-12/h3-7H,8H2,1-2H3