ethyl 4-[3-methyl-2,4-bis(oxidanylidene)-5-[(2-phenylphenyl)methyl]-1H-pyrimidin-6-yl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[3-methyl-2,4-bis(oxidanylidene)-5-[(2-phenylphenyl)methyl]-1H-pyrimidin-6-yl]piperazine-1-carboxylate Openeye Name: ethyl 4-[3-methyl-2,4-dioxo-5-[(2-phenylphenyl)methyl]-1H-pyrimidin-6-yl]piperazine-1-carboxylate CAS Name: 4-[3-methyl-2,4-dioxo-5-[(2-phenylphenyl)methyl]-1H-pyrimidin-6-yl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-methyl-2,4-dioxo-5-[(2-phenylphenyl)methyl]-1H-pyrimidin-6-yl]piperazine-1-carboxylate Traditional Name: 4-[2,4-diketo-3-methyl-5-(2-phenylbenzyl)-1H-pyrimidin-6-yl]piperazine-1-carboxylic acid ethyl ester Formula: C25H28N4O4 MolecularWeight: 448.51422

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C2=C(C(=O)N(C(=O)N2)C)CC3=CC=CC=C3C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C2=C(C(=O)N(C(=O)N2)C)CC3=CC=CC=C3C4=CC=CC=C4

InChI

InChI=1S/C25H28N4O4/c1-3-33-25(32)29-15-13-28(14-16-29)22-21(23(30)27(2)24(31)26-22)17-19-11-7-8-12-20(19)18-9-5-4-6-10-18/h4-12H,3,13-17H2,1-2H3,(H,26,31)