methyl 4-[3-(6-methyl-2-morpholin-4-yl-4-oxidanylidene-1H-pyrimidin-5-yl)propanoylamino]benzoate

Systemtic Name: methyl 4-[3-(6-methyl-2-morpholin-4-yl-4-oxidanylidene-1H-pyrimidin-5-yl)propanoylamino]benzoate Openeye Name: methyl 4-[3-(6-methyl-2-morpholino-4-oxo-1H-pyrimidin-5-yl)propanoylamino]benzoate CAS Name: 4-[[3-[6-methyl-2-(4-morpholinyl)-4-oxo-1H-pyrimidin-5-yl]-1-oxopropyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[3-(6-methyl-2-morpholin-4-yl-4-oxo-1H-pyrimidin-5-yl)propanoylamino]benzoate Traditional Name: 4-[3-(4-keto-6-methyl-2-morpholino-1H-pyrimidin-5-yl)propanoylamino]benzoic acid methyl ester Formula: C20H24N4O5 MolecularWeight: 400.42836

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)N2CCOCC2)CCC(=O)NC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CC1=C(C(=O)N=C(N1)N2CCOCC2)CCC(=O)NC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C20H24N4O5/c1-13-16(18(26)23-20(21-13)24-9-11-29-12-10-24)7-8-17(25)22-15-5-3-14(4-6-15)19(27)28-2/h3-6H,7-12H2,1-2H3,(H,22,25)(H,21,23,26)