methyl (6R)-6-(4-imidazol-1-ylphenyl)-4-methyl-3-propyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: methyl (6R)-6-(4-imidazol-1-ylphenyl)-4-methyl-3-propyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: methyl (6R)-6-(4-imidazol-1-ylphenyl)-4-methyl-3-propyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: (6R)-6-[4-(1-imidazolyl)phenyl]-4-methyl-3-propyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl (6R)-6-(4-imidazol-1-ylphenyl)-4-methyl-3-propyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Traditional Name: (6R)-6-(4-imidazol-1-ylphenyl)-4-methyl-3-propyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylic acid methyl ester Formula: C19H22N4O2S MolecularWeight: 370.46858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C(NC1=S)C2=CC=C(C=C2)N3C=CN=C3)C(=O)OC)C

Isomeric SMILES

CCCN1C(=C([C@H](NC1=S)C2=CC=C(C=C2)N3C=CN=C3)C(=O)OC)C

InChI

InChI=1S/C19H22N4O2S/c1-4-10-23-13(2)16(18(24)25-3)17(21-19(23)26)14-5-7-15(8-6-14)22-11-9-20-12-22/h5-9,11-12,17H,4,10H2,1-3H3,(H,21,26)/t17-/m1/s1