Vitas-M small molecule compound
3-{5-[(E)-(2,5-dioxoimidazolidin-4-ylidene)methyl]furan-2-yl}-4-methylbenzoic acid
Catalog ID
STK036289
SMILES O=C1N/C(=C/c2ccc(o2)c2cc(ccc2C)C(=O)O)/C(=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 C16H12N2O5 MW 312.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12N2O5/c1-8-2-3-9(15(20)21)6-11(8)13-5-4-10(23-13)7-12-14(19)18-16(22)17-12/h2-7H,1H3,(H,20,21)(H2,17,18,19,22)/b12-7+InChIKey
TURBDDXSHZASGX-KPKJPENVSA-NSynonyms
3(5((E)(25DIOXOIMIDAZOLIDIN4YLIDENE)METHYL)FURAN2YL)4METHYLBENZOICACID
CC1=C(C=C(C=C1)C(=O)O)C2=CC=C(O2)C=C3C(=O)NC(=O)N3
InChI=1SC16H12N2O5c18239(15(20)21)611(8)135410(2313)71214(19)1816(22)1712h27H1H3(H2021)(H217181922)b127+
MFCD03142928
O=C1NC(=Cc2ccc(o2)c2cc(ccc2C)C(=O)O)C(=O)N1
STK036289
ZINC000000072898
ZINC72898
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Check stock on Vitas-MAvailable files
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