(2S)-1-[3-(2-bromanyl-4,5-dimethoxy-phenyl)propanoyl]-4-methyl-2-(phenylmethyl)-2H-pyrazin-3-one

Systemtic Name: (2S)-1-[3-(2-bromanyl-4,5-dimethoxy-phenyl)propanoyl]-4-methyl-2-(phenylmethyl)-2H-pyrazin-3-one Openeye Name: (2S)-2-benzyl-1-[3-(2-bromo-4,5-dimethoxy-phenyl)propanoyl]-4-methyl-2H-pyrazin-3-one CAS Name: (2S)-1-[3-(2-bromo-4,5-dimethoxyphenyl)-1-oxopropyl]-4-methyl-2-(phenylmethyl)-2H-pyrazin-3-one IUPAC Name: (2S)-2-benzyl-1-[3-(2-bromo-4,5-dimethoxyphenyl)propanoyl]-4-methyl-2H-pyrazin-3-one Traditional Name: (2S)-2-benzyl-1-[3-(2-bromo-4,5-dimethoxy-phenyl)propanoyl]-4-methyl-2H-pyrazin-3-one Formula: C23H25BrN2O4 MolecularWeight: 473.3596

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN(C(C1=O)CC2=CC=CC=C2)C(=O)CCC3=CC(=C(C=C3Br)OC)OC

Isomeric SMILES

CN1C=CN([C@H](C1=O)CC2=CC=CC=C2)C(=O)CCC3=CC(=C(C=C3Br)OC)OC

InChI

InChI=1S/C23H25BrN2O4/c1-25-11-12-26(19(23(25)28)13-16-7-5-4-6-8-16)22(27)10-9-17-14-20(29-2)21(30-3)15-18(17)24/h4-8,11-12,14-15,19H,9-10,13H2,1-3H3/t19-/m0/s1