Vitas-M small molecule compound
3-{(3E)-2-(4-bromophenyl)-3-[hydroxy(2,4,6-trimethylphenyl)methylidene]-4,5-dioxopyrrolidin-1-yl}benzoic acid
Catalog ID
STK561524
SMILES Brc1ccc(cc1)C1N(c2cccc(c2)C(=O)O)C(=O)C(=O)/C/1=C(\c1c(C)cc(cc1C)C)/O
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C27H22BrNO5 MW 520.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22BrNO5/c1-14-11-15(2)21(16(3)12-14)24(30)22-23(17-7-9-19(28)10-8-17)29(26(32)25(22)31)20-6-4-5-18(13-20)27(33)34/h4-13,23,30H,1-3H3,(H,33,34)/b24-22+InChIKey
VILVYIOMSARIFZ-ZNTNEXAZSA-NSynonyms
332065-90-43((3E)2(4bromophenyl)3(hydroxy(246trimethylphenyl)methylidene)45dioxopyrrolidin1yl)benzoicacid
332065904
Brc1ccc(cc1)C1N(c2cccc(c2)C(=O)O)C(=O)C(=O)C1=C(c1c(C)cc(cc1C)C)O
CC1=CC(=C(C(=C1)C)C(=C2C(N(C(=O)C2=O)C3=CC=CC(=C3)C(=O)O)C4=CC=C(C=C4)Br)O)C
InChI=1SC27H22BrNO5c1141115(2)21(16(3)1214)24(30)2223(177919(28)10817)29(26(32)25(22)31)2064518(1320)27(33)34h4132330H13H3(H3334)b2422+
MFCD04082524
ZINC000101072715
ZINC000101072716
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