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

Systemtic Name: 2-methylpropyl 6-[3-[(3-fluorophenyl)carbonylamino]phenyl]-4-methyl-2-oxidanylidene-3-propyl-1,6-dihydropyrimidine-5-carboxylate Openeye Name: isobutyl 6-[3-[(3-fluorobenzoyl)amino]phenyl]-4-methyl-2-oxo-3-propyl-1,6-dihydropyrimidine-5-carboxylate CAS Name: 6-[3-[[(3-fluorophenyl)-oxomethyl]amino]phenyl]-4-methyl-2-oxo-3-propyl-1,6-dihydropyrimidine-5-carboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 6-[3-[(3-fluorobenzoyl)amino]phenyl]-4-methyl-2-oxo-3-propyl-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 6-[3-[(3-fluorobenzoyl)amino]phenyl]-2-keto-4-methyl-3-propyl-1,6-dihydropyrimidine-5-carboxylic acid isobutyl ester Formula: C26H30FN3O4 MolecularWeight: 467.532503

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C(NC1=O)C2=CC(=CC=C2)NC(=O)C3=CC(=CC=C3)F)C(=O)OCC(C)C)C

Isomeric SMILES

CCCN1C(=C(C(NC1=O)C2=CC(=CC=C2)NC(=O)C3=CC(=CC=C3)F)C(=O)OCC(C)C)C

InChI

InChI=1S/C26H30FN3O4/c1-5-12-30-17(4)22(25(32)34-15-16(2)3)23(29-26(30)33)18-8-7-11-21(14-18)28-24(31)19-9-6-10-20(27)13-19/h6-11,13-14,16,23H,5,12,15H2,1-4H3,(H,28,31)(H,29,33)