methyl (4S)-4-(2,4-dimethylphenyl)-6-[(2-morpholin-4-ylethylamino)methyl]-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: methyl (4S)-4-(2,4-dimethylphenyl)-6-[(2-morpholin-4-ylethylamino)methyl]-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: methyl (4S)-4-(2,4-dimethylphenyl)-6-[(2-morpholinoethylamino)methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4S)-4-(2,4-dimethylphenyl)-6-[[2-(4-morpholinyl)ethylamino]methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl (4S)-4-(2,4-dimethylphenyl)-6-[(2-morpholin-4-ylethylamino)methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4S)-4-(2,4-dimethylphenyl)-2-keto-6-[(2-morpholinoethylamino)methyl]-3,4-dihydro-1H-pyrimidine-5-carboxylic acid methyl ester Formula: C21H30N4O4 MolecularWeight: 402.4873

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2C(=C(NC(=O)N2)CNCCN3CCOCC3)C(=O)OC)C

Isomeric SMILES

CC1=CC(=C(C=C1)[C@H]2C(=C(NC(=O)N2)CNCCN3CCOCC3)C(=O)OC)C

InChI

InChI=1S/C21H30N4O4/c1-14-4-5-16(15(2)12-14)19-18(20(26)28-3)17(23-21(27)24-19)13-22-6-7-25-8-10-29-11-9-25/h4-5,12,19,22H,6-11,13H2,1-3H3,(H2,23,24,27)/t19-/m0/s1