ethyl (4S)-6-[(3-chloranylpyridin-2-yl)sulfanylmethyl]-4-ethyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl (4S)-6-[(3-chloranylpyridin-2-yl)sulfanylmethyl]-4-ethyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl (4S)-6-[(3-chloro-2-pyridyl)sulfanylmethyl]-4-ethyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4S)-6-[[(3-chloro-2-pyridinyl)thio]methyl]-4-ethyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (4S)-6-[(3-chloropyridin-2-yl)sulfanylmethyl]-4-ethyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4S)-6-[[(3-chloro-2-pyridyl)thio]methyl]-4-ethyl-2-keto-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C15H18ClN3O3S MolecularWeight: 355.83972

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=C(NC(=O)N1)CSC2=C(C=CC=N2)Cl)C(=O)OCC

Isomeric SMILES

CC[C@H]1C(=C(NC(=O)N1)CSC2=C(C=CC=N2)Cl)C(=O)OCC

InChI

InChI=1S/C15H18ClN3O3S/c1-3-10-12(14(20)22-4-2)11(19-15(21)18-10)8-23-13-9(16)6-5-7-17-13/h5-7,10H,3-4,8H2,1-2H3,(H2,18,19,21)/t10-/m0/s1