6-(2-bromanyl-5-methoxy-4-oxidanyl-phenyl)-5-ethanoyl-4-methyl-3-(phenylmethyl)-1,6-dihydropyrimidin-2-one

Systemtic Name: 6-(2-bromanyl-5-methoxy-4-oxidanyl-phenyl)-5-ethanoyl-4-methyl-3-(phenylmethyl)-1,6-dihydropyrimidin-2-one Openeye Name: 5-acetyl-3-benzyl-6-(2-bromo-4-hydroxy-5-methoxy-phenyl)-4-methyl-1,6-dihydropyrimidin-2-one CAS Name: 5-acetyl-6-(2-bromo-4-hydroxy-5-methoxyphenyl)-4-methyl-3-(phenylmethyl)-1,6-dihydropyrimidin-2-one IUPAC Name: 5-acetyl-3-benzyl-6-(2-bromo-4-hydroxy-5-methoxyphenyl)-4-methyl-1,6-dihydropyrimidin-2-one Traditional Name: 5-acetyl-3-benzyl-6-(2-bromo-4-hydroxy-5-methoxy-phenyl)-4-methyl-1,6-dihydropyrimidin-2-one Formula: C21H21BrN2O4 MolecularWeight: 445.30644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=O)N1CC2=CC=CC=C2)C3=CC(=C(C=C3Br)O)OC)C(=O)C

Isomeric SMILES

CC1=C(C(NC(=O)N1CC2=CC=CC=C2)C3=CC(=C(C=C3Br)O)OC)C(=O)C

InChI

InChI=1S/C21H21BrN2O4/c1-12-19(13(2)25)20(15-9-18(28-3)17(26)10-16(15)22)23-21(27)24(12)11-14-7-5-4-6-8-14/h4-10,20,26H,11H2,1-3H3,(H,23,27)