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

Systemtic Name: methyl 4-[(6S)-3-cyclopropyl-4-methyl-5-morpholin-4-ylcarbonyl-2-oxidanylidene-1,6-dihydropyrimidin-6-yl]benzoate Openeye Name: methyl 4-[(6S)-3-cyclopropyl-4-methyl-5-(morpholine-4-carbonyl)-2-oxo-1,6-dihydropyrimidin-6-yl]benzoate CAS Name: 4-[(6S)-3-cyclopropyl-4-methyl-5-[4-morpholinyl(oxo)methyl]-2-oxo-1,6-dihydropyrimidin-6-yl]benzoic acid methyl ester IUPAC Name: methyl 4-[(6S)-3-cyclopropyl-4-methyl-5-(morpholine-4-carbonyl)-2-oxo-1,6-dihydropyrimidin-6-yl]benzoate Traditional Name: 4-[(6S)-3-cyclopropyl-2-keto-4-methyl-5-(morpholine-4-carbonyl)-1,6-dihydropyrimidin-6-yl]benzoic acid methyl ester Formula: C21H25N3O5 MolecularWeight: 399.4403

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=O)N1C2CC2)C3=CC=C(C=C3)C(=O)OC)C(=O)N4CCOCC4

Isomeric SMILES

CC1=C([C@@H](NC(=O)N1C2CC2)C3=CC=C(C=C3)C(=O)OC)C(=O)N4CCOCC4

InChI

InChI=1S/C21H25N3O5/c1-13-17(19(25)23-9-11-29-12-10-23)18(22-21(27)24(13)16-7-8-16)14-3-5-15(6-4-14)20(26)28-2/h3-6,16,18H,7-12H2,1-2H3,(H,22,27)/t18-/m0/s1