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

Systemtic Name: ethyl (4S)-6-[(4-azanyl-6-methyl-pyrimidin-2-yl)sulfanylmethyl]-2-oxidanylidene-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl (4S)-6-[(4-amino-6-methyl-pyrimidin-2-yl)sulfanylmethyl]-2-oxo-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4S)-6-[[(4-amino-6-methyl-2-pyrimidinyl)thio]methyl]-2-oxo-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (4S)-6-[(4-amino-6-methylpyrimidin-2-yl)sulfanylmethyl]-2-oxo-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4S)-6-[[(4-amino-6-methyl-pyrimidin-2-yl)thio]methyl]-2-keto-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C19H21N5O3S MolecularWeight: 399.46674

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C2=CC=CC=C2)CSC3=NC(=CC(=N3)N)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)N[C@H]1C2=CC=CC=C2)CSC3=NC(=CC(=N3)N)C

InChI

InChI=1S/C19H21N5O3S/c1-3-27-17(25)15-13(10-28-19-21-11(2)9-14(20)23-19)22-18(26)24-16(15)12-7-5-4-6-8-12/h4-9,16H,3,10H2,1-2H3,(H2,20,21,23)(H2,22,24,26)/t16-/m0/s1