(E)-3-[2-(4-bromanylphenoxy)-9-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-3-yl]-2-cyano-N-phenethyl-prop-2-enamide

Systemtic Name: (E)-3-[2-(4-bromanylphenoxy)-9-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-3-yl]-2-cyano-N-phenethyl-prop-2-enamide Openeye Name: (E)-3-[2-(4-bromophenoxy)-9-methyl-4-oxo-pyrido[1,2-a]pyrimidin-3-yl]-2-cyano-N-phenethyl-prop-2-enamide CAS Name: (E)-3-[2-(4-bromophenoxy)-9-methyl-4-oxo-3-pyrido[1,2-a]pyrimidinyl]-2-cyano-N-phenethyl-2-propenamide IUPAC Name: (E)-3-[2-(4-bromophenoxy)-9-methyl-4-oxopyrido[1,2-a]pyrimidin-3-yl]-2-cyano-N-phenethylprop-2-enamide Traditional Name: (E)-3-[2-(4-bromophenoxy)-4-keto-9-methyl-pyrido[1,2-a]pyrimidin-3-yl]-2-cyano-N-phenethyl-acrylamide Formula: C27H21BrN4O3 MolecularWeight: 529.38464

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CN2C1=NC(=C(C2=O)C=C(C#N)C(=O)NCCC3=CC=CC=C3)OC4=CC=C(C=C4)Br

Isomeric SMILES

CC1=CC=CN2C1=NC(=C(C2=O)/C=C(\C#N)/C(=O)NCCC3=CC=CC=C3)OC4=CC=C(C=C4)Br

InChI

InChI=1S/C27H21BrN4O3/c1-18-6-5-15-32-24(18)31-26(35-22-11-9-21(28)10-12-22)23(27(32)34)16-20(17-29)25(33)30-14-13-19-7-3-2-4-8-19/h2-12,15-16H,13-14H2,1H3,(H,30,33)/b20-16+