(2S)-3-(4-bromanylpyrazol-1-yl)-N-(2-cyanocyclopenten-1-yl)-2-methyl-propanamide

Systemtic Name: (2S)-3-(4-bromanylpyrazol-1-yl)-N-(2-cyanocyclopenten-1-yl)-2-methyl-propanamide Openeye Name: (2S)-3-(4-bromopyrazol-1-yl)-N-(2-cyanocyclopenten-1-yl)-2-methyl-propanamide CAS Name: (2S)-3-(4-bromo-1-pyrazolyl)-N-(2-cyano-1-cyclopentenyl)-2-methylpropanamide IUPAC Name: (2S)-3-(4-bromopyrazol-1-yl)-N-(2-cyanocyclopenten-1-yl)-2-methylpropanamide Traditional Name: (2S)-3-(4-bromopyrazol-1-yl)-N-(2-cyanocyclopenten-1-yl)-2-methyl-propionamide Formula: C13H15BrN4O MolecularWeight: 323.1884

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1C=C(C=N1)Br)C(=O)NC2=C(CCC2)C#N

Isomeric SMILES

C[C@@H](CN1C=C(C=N1)Br)C(=O)NC2=C(CCC2)C#N

InChI

InChI=1S/C13H15BrN4O/c1-9(7-18-8-11(14)6-16-18)13(19)17-12-4-2-3-10(12)5-15/h6,8-9H,2-4,7H2,1H3,(H,17,19)/t9-/m0/s1