(2E)-N-(5-bromanylpyridin-2-yl)-2-cyano-2-(3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)ethanamide

Systemtic Name: (2E)-N-(5-bromanylpyridin-2-yl)-2-cyano-2-(3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)ethanamide Openeye Name: (2E)-N-(5-bromo-2-pyridyl)-2-cyano-2-(3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)acetamide CAS Name: (2E)-N-(5-bromo-2-pyridinyl)-2-cyano-2-(3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)acetamide IUPAC Name: (2E)-N-(5-bromopyridin-2-yl)-2-cyano-2-(3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)acetamide Traditional Name: (2E)-N-(5-bromo-2-pyridyl)-2-cyano-2-(3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)acetamide Formula: C19H17BrN4O MolecularWeight: 397.26848

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=CC=CC=C2C(=C(C#N)C(=O)NC3=NC=C(C=C3)Br)N1)C

Isomeric SMILES

CC1(CC2=CC=CC=C2/C(=C(/C#N)\C(=O)NC3=NC=C(C=C3)Br)/N1)C

InChI

InChI=1S/C19H17BrN4O/c1-19(2)9-12-5-3-4-6-14(12)17(24-19)15(10-21)18(25)23-16-8-7-13(20)11-22-16/h3-8,11,24H,9H2,1-2H3,(H,22,23,25)/b17-15+