(E)-3-[2-(4-bromanylphenoxy)-7-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-3-yl]-2-cyano-N-ethyl-prop-2-enamide

Systemtic Name: (E)-3-[2-(4-bromanylphenoxy)-7-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-3-yl]-2-cyano-N-ethyl-prop-2-enamide Openeye Name: (E)-3-[2-(4-bromophenoxy)-7-methyl-4-oxo-pyrido[1,2-a]pyrimidin-3-yl]-2-cyano-N-ethyl-prop-2-enamide CAS Name: (E)-3-[2-(4-bromophenoxy)-7-methyl-4-oxo-3-pyrido[1,2-a]pyrimidinyl]-2-cyano-N-ethyl-2-propenamide IUPAC Name: (E)-3-[2-(4-bromophenoxy)-7-methyl-4-oxopyrido[1,2-a]pyrimidin-3-yl]-2-cyano-N-ethylprop-2-enamide Traditional Name: (E)-3-[2-(4-bromophenoxy)-4-keto-7-methyl-pyrido[1,2-a]pyrimidin-3-yl]-2-cyano-N-ethyl-acrylamide Formula: C21H17BrN4O3 MolecularWeight: 453.28868

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C(=CC1=C(N=C2C=CC(=CN2C1=O)C)OC3=CC=C(C=C3)Br)C#N

Isomeric SMILES

CCNC(=O)/C(=C/C1=C(N=C2C=CC(=CN2C1=O)C)OC3=CC=C(C=C3)Br)/C#N

InChI

InChI=1S/C21H17BrN4O3/c1-3-24-19(27)14(11-23)10-17-20(29-16-7-5-15(22)6-8-16)25-18-9-4-13(2)12-26(18)21(17)28/h4-10,12H,3H2,1-2H3,(H,24,27)/b14-10+