ethyl (4S)-4-ethyl-6-[[(4-methylphenyl)methylamino]methyl]-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl (4S)-4-ethyl-6-[[(4-methylphenyl)methylamino]methyl]-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl (4S)-4-ethyl-2-oxo-6-[(p-tolylmethylamino)methyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4S)-4-ethyl-6-[[(4-methylphenyl)methylamino]methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (4S)-4-ethyl-6-[[(4-methylphenyl)methylamino]methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4S)-4-ethyl-2-keto-6-[[(4-methylbenzyl)amino]methyl]-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C18H25N3O3 MolecularWeight: 331.4094

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=C(NC(=O)N1)CNCC2=CC=C(C=C2)C)C(=O)OCC

Isomeric SMILES

CC[C@H]1C(=C(NC(=O)N1)CNCC2=CC=C(C=C2)C)C(=O)OCC

InChI

InChI=1S/C18H25N3O3/c1-4-14-16(17(22)24-5-2)15(21-18(23)20-14)11-19-10-13-8-6-12(3)7-9-13/h6-9,14,19H,4-5,10-11H2,1-3H3,(H2,20,21,23)/t14-/m0/s1