Vitas-M small molecule compound
4-({2-bromo-4-[(E)-(2,5-dioxoimidazolidin-4-ylidene)methyl]phenoxy}methyl)benzoic acid
Catalog ID
STK065171
SMILES O=C1NC(=O)/C(=C\c2ccc(c(c2)Br)OCc2ccc(cc2)C(=O)O)/N1
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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 C18H13BrN2O5 MW 417.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13BrN2O5/c19-13-7-11(8-14-16(22)21-18(25)20-14)3-6-15(13)26-9-10-1-4-12(5-2-10)17(23)24/h1-8H,9H2,(H,23,24)(H2,20,21,22,25)/b14-8+InChIKey
NCMBWTOJTUAXPU-RIYZIHGNSA-NSynonyms
4((2BROMO4((E)(25DIOXOIMIDAZOLIDIN4YLIDENE)METHYL)PHENOXY)METHYL)BENZOICACID
C1=CC(=CC=C1COC2=C(C=C(C=C2)C=C3C(=O)NC(=O)N3)Br)C(=O)O
InChI=1SC18H13BrN2O5c1913711(81416(22)2118(25)2014)3615(13)269101412(5210)17(23)24h18H9H2(H2324)(H220212225)b148+
MFCD03141504
O=C1NC(=O)C(=Cc2ccc(c(c2)Br)OCc2ccc(cc2)C(=O)O)N1
STK065171
ZINC000001152243
ZINC1152243
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