prop-2-enyl (6R)-6-[2,4-bis(fluoranyl)phenyl]-4-methyl-3-phenyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: prop-2-enyl (6R)-6-[2,4-bis(fluoranyl)phenyl]-4-methyl-3-phenyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: allyl (6R)-6-(2,4-difluorophenyl)-4-methyl-3-phenyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: (6R)-6-(2,4-difluorophenyl)-4-methyl-3-phenyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl (6R)-6-(2,4-difluorophenyl)-4-methyl-3-phenyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Traditional Name: (6R)-6-(2,4-difluorophenyl)-4-methyl-3-phenyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylic acid allyl ester Formula: C21H18F2N2O2S MolecularWeight: 400.441626

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=S)N1C2=CC=CC=C2)C3=C(C=C(C=C3)F)F)C(=O)OCC=C

Isomeric SMILES

CC1=C([C@@H](NC(=S)N1C2=CC=CC=C2)C3=C(C=C(C=C3)F)F)C(=O)OCC=C

InChI

InChI=1S/C21H18F2N2O2S/c1-3-11-27-20(26)18-13(2)25(15-7-5-4-6-8-15)21(28)24-19(18)16-10-9-14(22)12-17(16)23/h3-10,12,19H,1,11H2,2H3,(H,24,28)/t19-/m0/s1