cyclohexylmethyl 6-ethyl-4-(3-fluorophenyl)-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: cyclohexylmethyl 6-ethyl-4-(3-fluorophenyl)-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: cyclohexylmethyl 6-ethyl-4-(3-fluorophenyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-ethyl-4-(3-fluorophenyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid cyclohexylmethyl ester IUPAC Name: cyclohexylmethyl 6-ethyl-4-(3-fluorophenyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-ethyl-4-(3-fluorophenyl)-2-keto-3,4-dihydro-1H-pyrimidine-5-carboxylic acid cyclohexylmethyl ester Formula: C20H25FN2O3 MolecularWeight: 360.422503

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25FN2O3/c1-2-16-17(19(24)26-12-13-7-4-3-5-8-13)18(23-20(25)22-16)14-9-6-10-15(21)11-14/h6,9-11,13,18H,2-5,7-8,12H2,1H3,(H2,22,23,25)