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

Systemtic Name: ethyl (4S)-6-[[(3,4-dichlorophenyl)methyl-methyl-amino]methyl]-4-ethyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl (4S)-6-[[(3,4-dichlorophenyl)methyl-methyl-amino]methyl]-4-ethyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4S)-6-[[(3,4-dichlorophenyl)methyl-methylamino]methyl]-4-ethyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (4S)-6-[[(3,4-dichlorophenyl)methyl-methylamino]methyl]-4-ethyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4S)-6-[[(3,4-dichlorobenzyl)-methyl-amino]methyl]-4-ethyl-2-keto-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C18H23Cl2N3O3 MolecularWeight: 400.29952

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H23Cl2N3O3/c1-4-14-16(17(24)26-5-2)15(22-18(25)21-14)10-23(3)9-11-6-7-12(19)13(20)8-11/h6-8,14H,4-5,9-10H2,1-3H3,(H2,21,22,25)/t14-/m0/s1