(E)-2-cyano-N-ethyl-3-[2-(5-methyl-2-propan-2-yl-phenoxy)-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl]prop-2-enamide

Systemtic Name: (E)-2-cyano-N-ethyl-3-[2-(5-methyl-2-propan-2-yl-phenoxy)-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl]prop-2-enamide Openeye Name: (E)-2-cyano-N-ethyl-3-[2-(2-isopropyl-5-methyl-phenoxy)-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl]prop-2-enamide CAS Name: (E)-2-cyano-N-ethyl-3-[2-(5-methyl-2-propan-2-ylphenoxy)-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl]-2-propenamide IUPAC Name: (E)-2-cyano-N-ethyl-3-[2-(5-methyl-2-propan-2-ylphenoxy)-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl]prop-2-enamide Traditional Name: (E)-2-cyano-N-ethyl-3-[2-(2-isopropyl-5-methyl-phenoxy)-4-keto-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl]acrylamide Formula: C24H25N4O3+ MolecularWeight: 417.4803

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C(=CC1=C(NC2=CC=CC=[N+]2C1=O)OC3=C(C=CC(=C3)C)C(C)C)C#N

Isomeric SMILES

CCNC(=O)/C(=C/C1=C(NC2=CC=CC=[N+]2C1=O)OC3=C(C=CC(=C3)C)C(C)C)/C#N

InChI

InChI=1S/C24H24N4O3/c1-5-26-22(29)17(14-25)13-19-23(27-21-8-6-7-11-28(21)24(19)30)31-20-12-16(4)9-10-18(20)15(2)3/h6-13,15H,5H2,1-4H3,(H,26,29)/p+1/b17-13+