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

Systemtic Name: ethyl (4S)-6-[[(4-dimethylaminophenyl)methyl-ethyl-amino]methyl]-4-ethyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl (4S)-6-[[(4-dimethylaminophenyl)methyl-ethyl-amino]methyl]-4-ethyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4S)-6-[[(4-dimethylaminophenyl)methyl-ethylamino]methyl]-4-ethyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (4S)-6-[[(4-dimethylaminophenyl)methyl-ethylamino]methyl]-4-ethyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4S)-6-[[[4-(dimethylamino)benzyl]-ethyl-amino]methyl]-4-ethyl-2-keto-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C21H32N4O3 MolecularWeight: 388.50378

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H32N4O3/c1-6-17-19(20(26)28-8-3)18(23-21(27)22-17)14-25(7-2)13-15-9-11-16(12-10-15)24(4)5/h9-12,17H,6-8,13-14H2,1-5H3,(H2,22,23,27)/t17-/m0/s1