(E)-2-cyano-3-[2-(2,4-dimethylphenoxy)-4-oxidanylidene-pyrido[1,2-a]pyrimidin-3-yl]-N-(phenylmethyl)prop-2-enamide

Systemtic Name: (E)-2-cyano-3-[2-(2,4-dimethylphenoxy)-4-oxidanylidene-pyrido[1,2-a]pyrimidin-3-yl]-N-(phenylmethyl)prop-2-enamide Openeye Name: (E)-N-benzyl-2-cyano-3-[2-(2,4-dimethylphenoxy)-4-oxo-pyrido[1,2-a]pyrimidin-3-yl]prop-2-enamide CAS Name: (E)-2-cyano-3-[2-(2,4-dimethylphenoxy)-4-oxo-3-pyrido[1,2-a]pyrimidinyl]-N-(phenylmethyl)-2-propenamide IUPAC Name: (E)-N-benzyl-2-cyano-3-[2-(2,4-dimethylphenoxy)-4-oxopyrido[1,2-a]pyrimidin-3-yl]prop-2-enamide Traditional Name: (E)-N-benzyl-2-cyano-3-[2-(2,4-dimethylphenoxy)-4-keto-pyrido[1,2-a]pyrimidin-3-yl]acrylamide Formula: C27H22N4O3 MolecularWeight: 450.48858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC2=C(C(=O)N3C=CC=CC3=N2)C=C(C#N)C(=O)NCC4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=C(C=C1)OC2=C(C(=O)N3C=CC=CC3=N2)/C=C(\C#N)/C(=O)NCC4=CC=CC=C4)C

InChI

InChI=1S/C27H22N4O3/c1-18-11-12-23(19(2)14-18)34-26-22(27(33)31-13-7-6-10-24(31)30-26)15-21(16-28)25(32)29-17-20-8-4-3-5-9-20/h3-15H,17H2,1-2H3,(H,29,32)/b21-15+