Vitas-M small molecule compound
5-[(4-bromo-3-nitro-1H-pyrazol-1-yl)methyl]-N'-[(Z)-(6-nitro-1,3-benzodioxol-5-yl)methylidene]furan-2-carbohydrazide
Catalog ID
STK453121
SMILES O=C(c1ccc(o1)Cn1cc(c(n1)[N+](=O)[O-])Br)N/N=C\c1cc2OCOc2cc1[N+](=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 C17H11BrN6O8 MW 507.21 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H11BrN6O8/c18-11-7-22(21-16(11)24(28)29)6-10-1-2-13(32-10)17(25)20-19-5-9-3-14-15(31-8-30-14)4-12(9)23(26)27/h1-5,7H,6,8H2,(H,20,25)/b19-5-InChIKey
SHDDVEOXKLYXSI-IPKBDRFQSA-NSynonyms
5((4BROMO3NITRO1HPYRAZOL1YL)METHYL)N((6NITRO13BENZODIOXOL5YL)METHYLENE)2FUROHYDRAZIDE
5((4bromo3nitro1Hpyrazol1yl)methyl)N((Z)(6nitro13benzodioxol5yl)methylidene)furan2carbohydrazide
5((4BROMO3NITROPYRAZOL1YL)METHYL)N((Z)(6NITRO13BENZODIOXOL5YL)METHYLIDENEAMINO)FURAN2CARBOXAMIDE
C1OC2=C(O1)C=C(C(=C2)C=NNC(=O)C3=CC=C(O3)CN4C=C(C(=N4)(N+)(=O)(O))Br)(N+)(=O)(O)
InChI=1SC17H11BrN6O8c1811722(2116(11)24(28)29)6101213(3210)17(25)20195931415(3183014)412(9)23(26)27h157H68H2(H2025)b195
MFCD02606032
N((1Z)2(6NITRO(2HBENZO(34D)13DIOXOLAN5YL))1AZAVINYL)(5((4BROMO3NITROPYRAZOLYL)METHYL)(2FURYL))CARBOXAMIDE
O=C(c1ccc(o1)Cn1cc(c(n1)(N+)(=O)(O))Br)NN=Cc1cc2OCOc2cc1(N+)(=O)(O)
ZINC000008455936
ZINC2759953
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