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

Systemtic Name: (E)-3-[2-(4-bromanylphenoxy)-7-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-3-yl]-2-cyano-N-phenethyl-prop-2-enamide Openeye Name: (E)-3-[2-(4-bromophenoxy)-7-methyl-4-oxo-pyrido[1,2-a]pyrimidin-3-yl]-2-cyano-N-phenethyl-prop-2-enamide CAS Name: (E)-3-[2-(4-bromophenoxy)-7-methyl-4-oxo-3-pyrido[1,2-a]pyrimidinyl]-2-cyano-N-phenethyl-2-propenamide IUPAC Name: (E)-3-[2-(4-bromophenoxy)-7-methyl-4-oxopyrido[1,2-a]pyrimidin-3-yl]-2-cyano-N-phenethylprop-2-enamide Traditional Name: (E)-3-[2-(4-bromophenoxy)-4-keto-7-methyl-pyrido[1,2-a]pyrimidin-3-yl]-2-cyano-N-phenethyl-acrylamide Formula: C27H21BrN4O3 MolecularWeight: 529.38464

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN2C(=NC(=C(C2=O)C=C(C#N)C(=O)NCCC3=CC=CC=C3)OC4=CC=C(C=C4)Br)C=C1

Isomeric SMILES

CC1=CN2C(=NC(=C(C2=O)/C=C(\C#N)/C(=O)NCCC3=CC=CC=C3)OC4=CC=C(C=C4)Br)C=C1

InChI

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