(2R)-5-(6-bromanyl-1H-indol-3-yl)-2-[6-bromanyl-1-(4-methylphenyl)sulfonyl-indol-3-yl]-2,3-dihydro-1H-pyrazin-6-one

SpectraBase Compound ID	8010zTqNBKa
InChI	InChI=1S/C27H20Br2N4O3S/c1-15-2-6-18(7-3-15)37(35,36)33-14-22(20-9-5-17(29)11-25(20)33)24-13-31-26(27(34)32-24)21-12-30-23-10-16(28)4-8-19(21)23/h2-12,14,24,30H,13H2,1H3,(H,32,34)/t24-/m0/s1
InChIKey	XAAGAWLEGUCJIK-DEOSSOPVSA-N Google Search
Mol Weight	640.35 g/mol
Molecular Formula	C27H20Br2N4O3S
Exact Mass	637.962288 g/mol

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SpectraBase Spectrum ID	KwdbNWqXqwH
Name	(2R)-5-(6-bromanyl-1H-indol-3-yl)-2-[6-bromanyl-1-(4-methylphenyl)sulfonyl-indol-3-yl]-2,3-dihydro-1H-pyrazin-6-one
Comments	Less than 3 mono-isotopic peaks
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C27H20Br2N4O3S
InChI	InChI=1S/C27H20Br2N4O3S/c1-15-2-6-18(7-3-15)37(35,36)33-14-22(20-9-5-17(29)11-25(20)33)24-13-31-26(27(34)32-24)21-12-30-23-10-16(28)4-8-19(21)23/h2-12,14,24,30H,13H2,1H3,(H,32,34)/t24-/m0/s1
InChIKey	XAAGAWLEGUCJIK-DEOSSOPVSA-N
Molecular Weight	640.350 g/mol
SMILES	N1[C@@](CN=C(c2c[nH]c3cc(ccc23)Br)C1=O)(c1c[n](c2c1ccc(c2)Br)S(=O)(=O)c1ccc(C)cc1)[H]
SPLASH	splash10-000f-0100009000-80f5ae34f5cd7d84864c
Source of Spectrum	J-66-4869-16
Synonyms	(2R)-5-(6-bromo-1H-indol-3-yl)-2-(6-bromo-1-tosyl-indol-3-yl)-2,3-dihydro-1H-pyrazin-6-one (2R)-5-(6-bromo-1H-indol-3-yl)-2-[6-bromo-1-(4-methylphenyl)sulfonyl-3-indolyl]-2,3-dihydro-1H-pyrazin-6-one (2R)-5-(6-bromo-1H-indol-3-yl)-2-[6-bromo-1-(4-methylphenyl)sulfonylindol-3-yl]-2,3-dihydro-1H-pyrazin-6-one (2R)-5-(6-bromo-1H-indol-3-yl)-2-[6-bromo-1-(p-tolylsulfonyl)indol-3-yl]-2,3-dihydro-1H-pyrazin-6-one
Wiley ID	1535519