(E)-3-(6-bromanylpyridin-2-yl)-2-cyano-N-[(1S)-1-phenylpropyl]prop-2-enamide

Systemtic Name: (E)-3-(6-bromanylpyridin-2-yl)-2-cyano-N-[(1S)-1-phenylpropyl]prop-2-enamide Openeye Name: (E)-3-(6-bromo-2-pyridyl)-2-cyano-N-[(1S)-1-phenylpropyl]prop-2-enamide CAS Name: (E)-3-(6-bromo-2-pyridinyl)-2-cyano-N-[(1S)-1-phenylpropyl]-2-propenamide IUPAC Name: (E)-3-(6-bromopyridin-2-yl)-2-cyano-N-[(1S)-1-phenylpropyl]prop-2-enamide Traditional Name: (E)-3-(6-bromo-2-pyridyl)-2-cyano-N-[(1S)-1-phenylpropyl]acrylamide Formula: C18H16BrN3O MolecularWeight: 370.24314

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H16BrN3O/c1-2-16(13-7-4-3-5-8-13)22-18(23)14(12-20)11-15-9-6-10-17(19)21-15/h3-11,16H,2H2,1H3,(H,22,23)/b14-11+/t16-/m0/s1