prop-2-enyl (6R)-6-(3-fluorophenyl)-3-(4-methoxyphenyl)-4-methyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: prop-2-enyl (6R)-6-(3-fluorophenyl)-3-(4-methoxyphenyl)-4-methyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: allyl (6R)-6-(3-fluorophenyl)-3-(4-methoxyphenyl)-4-methyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: (6R)-6-(3-fluorophenyl)-3-(4-methoxyphenyl)-4-methyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl (6R)-6-(3-fluorophenyl)-3-(4-methoxyphenyl)-4-methyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Traditional Name: (6R)-6-(3-fluorophenyl)-3-(4-methoxyphenyl)-4-methyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylic acid allyl ester Formula: C22H21FN2O3S MolecularWeight: 412.477143

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H21FN2O3S/c1-4-12-28-21(26)19-14(2)25(17-8-10-18(27-3)11-9-17)22(29)24-20(19)15-6-5-7-16(23)13-15/h4-11,13,20H,1,12H2,2-3H3,(H,24,29)/t20-/m1/s1