2-methylpropyl (4S)-6-methyl-4-(3-phenoxyphenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: 2-methylpropyl (4S)-6-methyl-4-(3-phenoxyphenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: isobutyl (4S)-6-methyl-4-(3-phenoxyphenyl)-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4S)-6-methyl-4-(3-phenoxyphenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl (4S)-6-methyl-4-(3-phenoxyphenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4S)-6-methyl-4-(3-phenoxyphenyl)-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid isobutyl ester Formula: C22H24N2O3S MolecularWeight: 396.50256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=S)N1)C2=CC(=CC=C2)OC3=CC=CC=C3)C(=O)OCC(C)C

Isomeric SMILES

CC1=C([C@@H](NC(=S)N1)C2=CC(=CC=C2)OC3=CC=CC=C3)C(=O)OCC(C)C

InChI

InChI=1S/C22H24N2O3S/c1-14(2)13-26-21(25)19-15(3)23-22(28)24-20(19)16-8-7-11-18(12-16)27-17-9-5-4-6-10-17/h4-12,14,20H,13H2,1-3H3,(H2,23,24,28)/t20-/m0/s1