ethyl (4R)-6-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-4-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl (4R)-6-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-4-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl (4R)-6-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-4-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4R)-6-[[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)thio]methyl]-4-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (4R)-6-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-4-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4R)-6-[[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)thio]methyl]-2-keto-4-methyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C19H23N5O3S MolecularWeight: 401.48262

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC2=C(C(NC(=O)N2)C)C(=O)OCC)C3=CC=CC=C3

Isomeric SMILES

CCN1C(=NN=C1SCC2=C([C@H](NC(=O)N2)C)C(=O)OCC)C3=CC=CC=C3

InChI

InChI=1S/C19H23N5O3S/c1-4-24-16(13-9-7-6-8-10-13)22-23-19(24)28-11-14-15(17(25)27-5-2)12(3)20-18(26)21-14/h6-10,12H,4-5,11H2,1-3H3,(H2,20,21,26)/t12-/m1/s1