(E)-3-(5-bromanylpyridin-2-yl)-2-cyano-N-[(1S)-1-phenylethyl]prop-2-enamide

Systemtic Name: (E)-3-(5-bromanylpyridin-2-yl)-2-cyano-N-[(1S)-1-phenylethyl]prop-2-enamide Openeye Name: (E)-3-(5-bromo-2-pyridyl)-2-cyano-N-[(1S)-1-phenylethyl]prop-2-enamide CAS Name: (E)-3-(5-bromo-2-pyridinyl)-2-cyano-N-[(1S)-1-phenylethyl]-2-propenamide IUPAC Name: (E)-3-(5-bromopyridin-2-yl)-2-cyano-N-[(1S)-1-phenylethyl]prop-2-enamide Traditional Name: (E)-3-(5-bromo-2-pyridyl)-2-cyano-N-[(1S)-1-phenylethyl]acrylamide Formula: C17H14BrN3O MolecularWeight: 356.21656

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)C(=CC2=NC=C(C=C2)Br)C#N

Isomeric SMILES

C[C@@H](C1=CC=CC=C1)NC(=O)/C(=C/C2=NC=C(C=C2)Br)/C#N

InChI

InChI=1S/C17H14BrN3O/c1-12(13-5-3-2-4-6-13)21-17(22)14(10-19)9-16-8-7-15(18)11-20-16/h2-9,11-12H,1H3,(H,21,22)/b14-9+/t12-/m0/s1