ethyl (4S)-4-(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl (4S)-4-(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl (4S)-4-(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4S)-4-(5-chloro-3-methyl-1-phenyl-4-pyrazolyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (4S)-4-(5-chloro-3-methyl-1-phenylpyrazol-4-yl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4S)-4-(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)-2-keto-6-methyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C18H19ClN4O3 MolecularWeight: 374.82146

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C2=C(N(N=C2C)C3=CC=CC=C3)Cl)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)N[C@@H]1C2=C(N(N=C2C)C3=CC=CC=C3)Cl)C

InChI

InChI=1S/C18H19ClN4O3/c1-4-26-17(24)14-10(2)20-18(25)21-15(14)13-11(3)22-23(16(13)19)12-8-6-5-7-9-12/h5-9,15H,4H2,1-3H3,(H2,20,21,25)/t15-/m1/s1