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

Systemtic Name: ethyl (4S)-4-(3-chloranyl-5-ethoxy-4-methoxy-phenyl)-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl (4S)-4-(3-chloro-5-ethoxy-4-methoxy-phenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4S)-4-(3-chloro-5-ethoxy-4-methoxyphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (4S)-4-(3-chloro-5-ethoxy-4-methoxyphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4S)-4-(3-chloro-5-ethoxy-4-methoxy-phenyl)-2-keto-6-methyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C17H21ClN2O5 MolecularWeight: 368.81204

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C2C(=C(NC(=O)N2)C)C(=O)OCC)Cl)OC

Isomeric SMILES

CCOC1=C(C(=CC(=C1)[C@H]2C(=C(NC(=O)N2)C)C(=O)OCC)Cl)OC

InChI

InChI=1S/C17H21ClN2O5/c1-5-24-12-8-10(7-11(18)15(12)23-4)14-13(16(21)25-6-2)9(3)19-17(22)20-14/h7-8,14H,5-6H2,1-4H3,(H2,19,20,22)/t14-/m0/s1