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

Systemtic Name: ethyl 6-[4-[(4-fluorophenyl)carbonylamino]phenyl]-2-oxidanylidene-4-phenyl-3-propyl-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 6-[4-[(4-fluorobenzoyl)amino]phenyl]-2-oxo-4-phenyl-3-propyl-1,6-dihydropyrimidine-5-carboxylate CAS Name: 6-[4-[[(4-fluorophenyl)-oxomethyl]amino]phenyl]-2-oxo-4-phenyl-3-propyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[4-[(4-fluorobenzoyl)amino]phenyl]-2-oxo-4-phenyl-3-propyl-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 6-[4-[(4-fluorobenzoyl)amino]phenyl]-2-keto-4-phenyl-3-propyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C29H28FN3O4 MolecularWeight: 501.548723

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C(NC1=O)C2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)F)C(=O)OCC)C4=CC=CC=C4

Isomeric SMILES

CCCN1C(=C(C(NC1=O)C2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)F)C(=O)OCC)C4=CC=CC=C4

InChI

InChI=1S/C29H28FN3O4/c1-3-18-33-26(20-8-6-5-7-9-20)24(28(35)37-4-2)25(32-29(33)36)19-12-16-23(17-13-19)31-27(34)21-10-14-22(30)15-11-21/h5-17,25H,3-4,18H2,1-2H3,(H,31,34)(H,32,36)