butyl (4S)-4-(4-bromanyl-2,5-dimethoxy-phenyl)-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: butyl (4S)-4-(4-bromanyl-2,5-dimethoxy-phenyl)-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: butyl (4S)-4-(4-bromo-2,5-dimethoxy-phenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4S)-4-(4-bromo-2,5-dimethoxyphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid butyl ester IUPAC Name: butyl (4S)-4-(4-bromo-2,5-dimethoxyphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4S)-4-(4-bromo-2,5-dimethoxy-phenyl)-2-keto-6-methyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid butyl ester Formula: C18H23BrN2O5 MolecularWeight: 427.28962

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=C(NC(=O)NC1C2=CC(=C(C=C2OC)Br)OC)C

Isomeric SMILES

CCCCOC(=O)C1=C(NC(=O)N[C@H]1C2=CC(=C(C=C2OC)Br)OC)C

InChI

InChI=1S/C18H23BrN2O5/c1-5-6-7-26-17(22)15-10(2)20-18(23)21-16(15)11-8-14(25-4)12(19)9-13(11)24-3/h8-9,16H,5-7H2,1-4H3,(H2,20,21,23)/t16-/m0/s1