methyl 4-[4-methyl-3-(3-methylbutyl)-5-morpholin-4-ylcarbonyl-2-oxidanylidene-1,6-dihydropyrimidin-6-yl]benzoate

Systemtic Name: methyl 4-[4-methyl-3-(3-methylbutyl)-5-morpholin-4-ylcarbonyl-2-oxidanylidene-1,6-dihydropyrimidin-6-yl]benzoate Openeye Name: methyl 4-[3-isopentyl-4-methyl-5-(morpholine-4-carbonyl)-2-oxo-1,6-dihydropyrimidin-6-yl]benzoate CAS Name: 4-[4-methyl-3-(3-methylbutyl)-5-[4-morpholinyl(oxo)methyl]-2-oxo-1,6-dihydropyrimidin-6-yl]benzoic acid methyl ester IUPAC Name: methyl 4-[4-methyl-3-(3-methylbutyl)-5-(morpholine-4-carbonyl)-2-oxo-1,6-dihydropyrimidin-6-yl]benzoate Traditional Name: 4-[3-isoamyl-2-keto-4-methyl-5-(morpholine-4-carbonyl)-1,6-dihydropyrimidin-6-yl]benzoic acid methyl ester Formula: C23H31N3O5 MolecularWeight: 429.50934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=O)N1CCC(C)C)C2=CC=C(C=C2)C(=O)OC)C(=O)N3CCOCC3

Isomeric SMILES

CC1=C(C(NC(=O)N1CCC(C)C)C2=CC=C(C=C2)C(=O)OC)C(=O)N3CCOCC3

InChI

InChI=1S/C23H31N3O5/c1-15(2)9-10-26-16(3)19(21(27)25-11-13-31-14-12-25)20(24-23(26)29)17-5-7-18(8-6-17)22(28)30-4/h5-8,15,20H,9-14H2,1-4H3,(H,24,29)