2-methylpropyl (4S)-4-(3-methoxy-4-propoxy-phenyl)-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: 2-methylpropyl (4S)-4-(3-methoxy-4-propoxy-phenyl)-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: isobutyl (4S)-4-(3-methoxy-4-propoxy-phenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4S)-4-(3-methoxy-4-propoxyphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl (4S)-4-(3-methoxy-4-propoxyphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4S)-2-keto-4-(3-methoxy-4-propoxy-phenyl)-6-methyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid isobutyl ester Formula: C20H28N2O5 MolecularWeight: 376.44672

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C2C(=C(NC(=O)N2)C)C(=O)OCC(C)C)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)[C@H]2C(=C(NC(=O)N2)C)C(=O)OCC(C)C)OC

InChI

InChI=1S/C20H28N2O5/c1-6-9-26-15-8-7-14(10-16(15)25-5)18-17(13(4)21-20(24)22-18)19(23)27-11-12(2)3/h7-8,10,12,18H,6,9,11H2,1-5H3,(H2,21,22,24)/t18-/m0/s1