Vitas-M small molecule compound
4-chloro-3-{5-[(E)-2-(4-hydroxy-5-nitro-6-oxo-1,6-dihydropyrimidin-2-yl)ethenyl]furan-2-yl}benzoic acid
Catalog ID
STK698032
SMILES Clc1ccc(cc1c1ccc(o1)/C=C/c1nc(O)c(c(=O)[nH]1)[N+](=O)[O-])C(=O)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 C17H10ClN3O7 MW 403.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H10ClN3O7/c18-11-4-1-8(17(24)25)7-10(11)12-5-2-9(28-12)3-6-13-19-15(22)14(21(26)27)16(23)20-13/h1-7H,(H,24,25)(H2,19,20,22,23)/b6-3+InChIKey
VHWVIHXKQPQXMO-ZZXKWVIFSA-NSynonyms
810695-34-2(E)4chloro3(5(2(4hydroxy5nitro6oxo16dihydropyrimidin2yl)vinyl)furan2yl)benzoicacid
3(5((1E)2(6HYDROXY5NITRO4OXO(3HYDROPYRIMIDIN2YL))VINYL)(2FURYL))4CHLOROBENZOICACID
4chloro3(5((E)2(4hydroxy5nitro6oxo16dihydropyrimidin2yl)ethenyl)furan2yl)benzoicacid
4CHLORO3(5((E)2(4HYDROXY5NITRO6OXO1HPYRIMIDIN2YL)ETHENYL)FURAN2YL)BENZOICACID
810695342
C1=CC(=C(C=C1C(=O)O)C2=CC=C(O2)C=CC3=NC(=C(C(=O)N3)(N+)(=O)(O))O)Cl
Clc1ccc(cc1c1ccc(o1)C=Cc1nc(O)c(c(=O)(nH)1)(N+)(=O)(O))C(=O)O
InChI=1SC17H10ClN3O7c1811418(17(24)25)710(11)12529(2812)36131915(22)14(21(26)27)16(23)2013h17H(H2425)(H219202223)b63+
MFCD05790507
ZINC000017056202
ZINC17056202
Check stock
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