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

Systemtic Name: methyl 4-(5-bromanyl-2-phenylmethoxy-phenyl)-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: methyl 4-(2-benzyloxy-5-bromo-phenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 4-(5-bromo-2-phenylmethoxyphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl 4-(5-bromo-2-phenylmethoxyphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 4-(2-benzoxy-5-bromo-phenyl)-2-keto-6-methyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid methyl ester Formula: C20H19BrN2O4 MolecularWeight: 431.27986

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=O)N1)C2=C(C=CC(=C2)Br)OCC3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CC1=C(C(NC(=O)N1)C2=C(C=CC(=C2)Br)OCC3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C20H19BrN2O4/c1-12-17(19(24)26-2)18(23-20(25)22-12)15-10-14(21)8-9-16(15)27-11-13-6-4-3-5-7-13/h3-10,18H,11H2,1-2H3,(H2,22,23,25)