ethyl 1-[[2-chloranyl-4-fluoranyl-5-[3-methyl-2,6-bis(oxidanylidene)-4-(trifluoromethyl)pyrimidin-1-yl]phenyl]carbamoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[[2-chloranyl-4-fluoranyl-5-[3-methyl-2,6-bis(oxidanylidene)-4-(trifluoromethyl)pyrimidin-1-yl]phenyl]carbamoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[[2-chloro-4-fluoro-5-[3-methyl-2,6-dioxo-4-(trifluoromethyl)pyrimidin-1-yl]phenyl]carbamoyl]piperidine-4-carboxylate CAS Name: 1-[[2-chloro-4-fluoro-5-[3-methyl-2,6-dioxo-4-(trifluoromethyl)-1-pyrimidinyl]anilino]-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[[2-chloro-4-fluoro-5-[3-methyl-2,6-dioxo-4-(trifluoromethyl)pyrimidin-1-yl]phenyl]carbamoyl]piperidine-4-carboxylate Traditional Name: 1-[[2-chloro-5-[2,6-diketo-3-methyl-4-(trifluoromethyl)pyrimidin-1-yl]-4-fluoro-phenyl]carbamoyl]isonipecotic acid ethyl ester Formula: C21H21ClF4N4O5 MolecularWeight: 520.861853

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)NC2=C(C=C(C(=C2)N3C(=O)C=C(N(C3=O)C)C(F)(F)F)F)Cl

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)NC2=C(C=C(C(=C2)N3C(=O)C=C(N(C3=O)C)C(F)(F)F)F)Cl

InChI

InChI=1S/C21H21ClF4N4O5/c1-3-35-18(32)11-4-6-29(7-5-11)19(33)27-14-9-15(13(23)8-12(14)22)30-17(31)10-16(21(24,25)26)28(2)20(30)34/h8-11H,3-7H2,1-2H3,(H,27,33)