2-methylpropyl (4S)-4-[5-(4-ethanoylphenyl)furan-2-yl]-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: 2-methylpropyl (4S)-4-[5-(4-ethanoylphenyl)furan-2-yl]-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: isobutyl (4S)-4-[5-(4-acetylphenyl)-2-furyl]-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4S)-4-[5-(4-acetylphenyl)-2-furanyl]-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl (4S)-4-[5-(4-acetylphenyl)furan-2-yl]-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4S)-4-[5-(4-acetylphenyl)-2-furyl]-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid isobutyl ester Formula: C22H24N2O4S MolecularWeight: 412.50196

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=S)N1)C2=CC=C(O2)C3=CC=C(C=C3)C(=O)C)C(=O)OCC(C)C

Isomeric SMILES

CC1=C([C@H](NC(=S)N1)C2=CC=C(O2)C3=CC=C(C=C3)C(=O)C)C(=O)OCC(C)C

InChI

InChI=1S/C22H24N2O4S/c1-12(2)11-27-21(26)19-13(3)23-22(29)24-20(19)18-10-9-17(28-18)16-7-5-15(6-8-16)14(4)25/h5-10,12,20H,11H2,1-4H3,(H2,23,24,29)/t20-/m1/s1