methyl 4-[[2,4-bis(fluoranyl)phenoxy]methyl]-3-cyclopropyl-2-oxidanylidene-6-phenyl-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: methyl 4-[[2,4-bis(fluoranyl)phenoxy]methyl]-3-cyclopropyl-2-oxidanylidene-6-phenyl-1,6-dihydropyrimidine-5-carboxylate Openeye Name: methyl 3-cyclopropyl-4-[(2,4-difluorophenoxy)methyl]-2-oxo-6-phenyl-1,6-dihydropyrimidine-5-carboxylate CAS Name: 3-cyclopropyl-4-[(2,4-difluorophenoxy)methyl]-2-oxo-6-phenyl-1,6-dihydropyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl 3-cyclopropyl-4-[(2,4-difluorophenoxy)methyl]-2-oxo-6-phenyl-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 3-cyclopropyl-4-[(2,4-difluorophenoxy)methyl]-2-keto-6-phenyl-1,6-dihydropyrimidine-5-carboxylic acid methyl ester Formula: C22H20F2N2O4 MolecularWeight: 414.402006

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(N(C(=O)NC1C2=CC=CC=C2)C3CC3)COC4=C(C=C(C=C4)F)F

Isomeric SMILES

COC(=O)C1=C(N(C(=O)NC1C2=CC=CC=C2)C3CC3)COC4=C(C=C(C=C4)F)F

InChI

InChI=1S/C22H20F2N2O4/c1-29-21(27)19-17(12-30-18-10-7-14(23)11-16(18)24)26(15-8-9-15)22(28)25-20(19)13-5-3-2-4-6-13/h2-7,10-11,15,20H,8-9,12H2,1H3,(H,25,28)