3-[2-(4-chloranyl-3-methyl-phenoxy)-9-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-3-yl]-2-morpholin-4-ylcarbonyl-prop-2-enenitrile

Systemtic Name: 3-[2-(4-chloranyl-3-methyl-phenoxy)-9-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-3-yl]-2-morpholin-4-ylcarbonyl-prop-2-enenitrile Openeye Name: 3-[2-(4-chloro-3-methyl-phenoxy)-9-methyl-4-oxo-pyrido[1,2-a]pyrimidin-3-yl]-2-(morpholine-4-carbonyl)prop-2-enenitrile CAS Name: 3-[2-(4-chloro-3-methylphenoxy)-9-methyl-4-oxo-3-pyrido[1,2-a]pyrimidinyl]-2-[4-morpholinyl(oxo)methyl]-2-propenenitrile IUPAC Name: 3-[2-(4-chloro-3-methylphenoxy)-9-methyl-4-oxopyrido[1,2-a]pyrimidin-3-yl]-2-(morpholine-4-carbonyl)prop-2-enenitrile Traditional Name: 3-[2-(4-chloro-3-methyl-phenoxy)-4-keto-9-methyl-pyrido[1,2-a]pyrimidin-3-yl]-2-(morpholine-4-carbonyl)acrylonitrile Formula: C24H21ClN4O4 MolecularWeight: 464.90094

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CN2C1=NC(=C(C2=O)C=C(C#N)C(=O)N3CCOCC3)OC4=CC(=C(C=C4)Cl)C

Isomeric SMILES

CC1=CC=CN2C1=NC(=C(C2=O)C=C(C#N)C(=O)N3CCOCC3)OC4=CC(=C(C=C4)Cl)C

InChI

InChI=1S/C24H21ClN4O4/c1-15-4-3-7-29-21(15)27-22(33-18-5-6-20(25)16(2)12-18)19(24(29)31)13-17(14-26)23(30)28-8-10-32-11-9-28/h3-7,12-13H,8-11H2,1-2H3