ethyl (4S)-4-(3-bromanyl-5-methoxy-4-propan-2-yloxy-phenyl)-2-oxidanylidene-6-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl (4S)-4-(3-bromanyl-5-methoxy-4-propan-2-yloxy-phenyl)-2-oxidanylidene-6-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl (4S)-4-(3-bromo-4-isopropoxy-5-methoxy-phenyl)-2-oxo-6-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4S)-4-(3-bromo-5-methoxy-4-propan-2-yloxyphenyl)-2-oxo-6-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (4S)-4-(3-bromo-5-methoxy-4-propan-2-yloxyphenyl)-2-oxo-6-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4S)-4-(3-bromo-4-isopropoxy-5-methoxy-phenyl)-2-keto-6-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C23H25BrN2O5 MolecularWeight: 489.359

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C2=CC(=C(C(=C2)Br)OC(C)C)OC)C3=CC=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C23H25BrN2O5/c1-5-30-22(27)18-19(14-9-7-6-8-10-14)25-23(28)26-20(18)15-11-16(24)21(31-13(2)3)17(12-15)29-4/h6-13,20H,5H2,1-4H3,(H2,25,26,28)/t20-/m0/s1