methyl 3-ethyl-6-[3-[(4-fluorophenyl)carbonylamino]phenyl]-4-methyl-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: methyl 3-ethyl-6-[3-[(4-fluorophenyl)carbonylamino]phenyl]-4-methyl-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: methyl 3-ethyl-6-[3-[(4-fluorobenzoyl)amino]phenyl]-4-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 3-ethyl-6-[3-[[(4-fluorophenyl)-oxomethyl]amino]phenyl]-4-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl 3-ethyl-6-[3-[(4-fluorobenzoyl)amino]phenyl]-4-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 3-ethyl-6-[3-[(4-fluorobenzoyl)amino]phenyl]-2-keto-4-methyl-1,6-dihydropyrimidine-5-carboxylic acid methyl ester Formula: C22H22FN3O4 MolecularWeight: 411.426183

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(NC1=O)C2=CC(=CC=C2)NC(=O)C3=CC=C(C=C3)F)C(=O)OC)C

Isomeric SMILES

CCN1C(=C(C(NC1=O)C2=CC(=CC=C2)NC(=O)C3=CC=C(C=C3)F)C(=O)OC)C

InChI

InChI=1S/C22H22FN3O4/c1-4-26-13(2)18(21(28)30-3)19(25-22(26)29)15-6-5-7-17(12-15)24-20(27)14-8-10-16(23)11-9-14/h5-12,19H,4H2,1-3H3,(H,24,27)(H,25,29)