(4S)-4-(4-ethoxy-3-methoxy-phenyl)-6-methyl-N-(3-nitrophenyl)-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide

Systemtic Name: (4S)-4-(4-ethoxy-3-methoxy-phenyl)-6-methyl-N-(3-nitrophenyl)-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide Openeye Name: (4S)-4-(4-ethoxy-3-methoxy-phenyl)-6-methyl-N-(3-nitrophenyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxamide CAS Name: (4S)-4-(4-ethoxy-3-methoxyphenyl)-6-methyl-N-(3-nitrophenyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxamide IUPAC Name: (4S)-4-(4-ethoxy-3-methoxyphenyl)-6-methyl-N-(3-nitrophenyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxamide Traditional Name: (4S)-4-(4-ethoxy-3-methoxy-phenyl)-2-keto-6-methyl-N-(3-nitrophenyl)-3,4-dihydro-1H-pyrimidine-5-carboxamide Formula: C21H22N4O6 MolecularWeight: 426.42258

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C2C(=C(NC(=O)N2)C)C(=O)NC3=CC(=CC=C3)[N+](=O)[O-])OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)[C@H]2C(=C(NC(=O)N2)C)C(=O)NC3=CC(=CC=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C21H22N4O6/c1-4-31-16-9-8-13(10-17(16)30-3)19-18(12(2)22-21(27)24-19)20(26)23-14-6-5-7-15(11-14)25(28)29/h5-11,19H,4H2,1-3H3,(H,23,26)(H2,22,24,27)/t19-/m0/s1