methyl 4-[1-(4-methyl-2-pyridin-4-yl-pyrimidin-5-yl)ethylamino]-4-oxidanylidene-butanoate

Systemtic Name: methyl 4-[1-(4-methyl-2-pyridin-4-yl-pyrimidin-5-yl)ethylamino]-4-oxidanylidene-butanoate Openeye Name: methyl 4-[1-[4-methyl-2-(4-pyridyl)pyrimidin-5-yl]ethylamino]-4-oxo-butanoate CAS Name: 4-[1-(4-methyl-2-pyridin-4-yl-5-pyrimidinyl)ethylamino]-4-oxobutanoic acid methyl ester IUPAC Name: methyl 4-[1-(4-methyl-2-pyridin-4-ylpyrimidin-5-yl)ethylamino]-4-oxobutanoate Traditional Name: 4-keto-4-[1-[4-methyl-2-(4-pyridyl)pyrimidin-5-yl]ethylamino]butyric acid methyl ester Formula: C17H20N4O3 MolecularWeight: 328.3657

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1C(C)NC(=O)CCC(=O)OC)C2=CC=NC=C2

Isomeric SMILES

CC1=NC(=NC=C1C(C)NC(=O)CCC(=O)OC)C2=CC=NC=C2

InChI

InChI=1S/C17H20N4O3/c1-11(20-15(22)4-5-16(23)24-3)14-10-19-17(21-12(14)2)13-6-8-18-9-7-13/h6-11H,4-5H2,1-3H3,(H,20,22)