ethyl 4-[3-(4-chlorophenyl)-2,4-bis(oxidanylidene)-1H-pyrimidin-6-yl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[3-(4-chlorophenyl)-2,4-bis(oxidanylidene)-1H-pyrimidin-6-yl]piperazine-1-carboxylate Openeye Name: ethyl 4-[3-(4-chlorophenyl)-2,4-dioxo-1H-pyrimidin-6-yl]piperazine-1-carboxylate CAS Name: 4-[3-(4-chlorophenyl)-2,4-dioxo-1H-pyrimidin-6-yl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-(4-chlorophenyl)-2,4-dioxo-1H-pyrimidin-6-yl]piperazine-1-carboxylate Traditional Name: 4-[3-(4-chlorophenyl)-2,4-diketo-1H-pyrimidin-6-yl]piperazine-1-carboxylic acid ethyl ester Formula: C17H19ClN4O4 MolecularWeight: 378.81016

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C2=CC(=O)N(C(=O)N2)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C2=CC(=O)N(C(=O)N2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H19ClN4O4/c1-2-26-17(25)21-9-7-20(8-10-21)14-11-15(23)22(16(24)19-14)13-5-3-12(18)4-6-13/h3-6,11H,2,7-10H2,1H3,(H,19,24)