cyclohexylmethyl 4-[3,5-bis(trifluoromethyl)phenyl]-6-ethyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: cyclohexylmethyl 4-[3,5-bis(trifluoromethyl)phenyl]-6-ethyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: cyclohexylmethyl 4-[3,5-bis(trifluoromethyl)phenyl]-6-ethyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 4-[3,5-bis(trifluoromethyl)phenyl]-6-ethyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid cyclohexylmethyl ester IUPAC Name: cyclohexylmethyl 4-[3,5-bis(trifluoromethyl)phenyl]-6-ethyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 4-[3,5-bis(trifluoromethyl)phenyl]-6-ethyl-2-keto-3,4-dihydro-1H-pyrimidine-5-carboxylic acid cyclohexylmethyl ester Formula: C22H24F6N2O3 MolecularWeight: 478.427979

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(NC(=O)N1)C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)C(=O)OCC3CCCCC3

Isomeric SMILES

CCC1=C(C(NC(=O)N1)C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)C(=O)OCC3CCCCC3

InChI

InChI=1S/C22H24F6N2O3/c1-2-16-17(19(31)33-11-12-6-4-3-5-7-12)18(30-20(32)29-16)13-8-14(21(23,24)25)10-15(9-13)22(26,27)28/h8-10,12,18H,2-7,11H2,1H3,(H2,29,30,32)