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

Systemtic Name: ethyl (4S)-6-[[(4-dimethylaminophenyl)methyl-methyl-amino]methyl]-4-ethyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl (4S)-6-[[(4-dimethylaminophenyl)methyl-methyl-amino]methyl]-4-ethyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4S)-6-[[(4-dimethylaminophenyl)methyl-methylamino]methyl]-4-ethyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (4S)-6-[[(4-dimethylaminophenyl)methyl-methylamino]methyl]-4-ethyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4S)-6-[[[4-(dimethylamino)benzyl]-methyl-amino]methyl]-4-ethyl-2-keto-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C20H30N4O3 MolecularWeight: 374.4772

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=C(NC(=O)N1)CN(C)CC2=CC=C(C=C2)N(C)C)C(=O)OCC

Isomeric SMILES

CC[C@H]1C(=C(NC(=O)N1)CN(C)CC2=CC=C(C=C2)N(C)C)C(=O)OCC

InChI

InChI=1S/C20H30N4O3/c1-6-16-18(19(25)27-7-2)17(22-20(26)21-16)13-24(5)12-14-8-10-15(11-9-14)23(3)4/h8-11,16H,6-7,12-13H2,1-5H3,(H2,21,22,26)/t16-/m0/s1