Vitas-M small molecule compound
9-(4-bromophenyl)-2-(4-chloro-3-nitrophenyl)tetrahydro-5H-pyrazolo[1,2-a]pyrrolo[3,4-c]pyrazole-1,3(2H,3aH)-dione
Catalog ID
STK998289
SMILES Brc1ccc(cc1)C1N2CCCN2C2C1C(=O)N(C2=O)c1ccc(c(c1)[N+](=O)[O-])Cl
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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 C20H16BrClN4O4 MW 491.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16BrClN4O4/c21-12-4-2-11(3-5-12)17-16-18(24-9-1-8-23(17)24)20(28)25(19(16)27)13-6-7-14(22)15(10-13)26(29)30/h2-7,10,16-18H,1,8-9H2InChIKey
BYKKAIQZBYCVGK-UHFFFAOYSA-NSynonyms
1024474-27-81024474278
9(4bromophenyl)2(4chloro3nitrophenyl)hexahydro1Hpyrazolo(12a)pyrrolo(34c)pyrazole13(2H)dione
9(4bromophenyl)2(4chloro3nitrophenyl)tetrahydro5Hpyrazolo(12a)pyrrolo(34c)pyrazole13(2H3aH)dione
Brc1ccc(cc1)C1N2CCCN2C2C1C(=O)N(C2=O)c1ccc(c(c1)(N+)(=O)(O))Cl
C1CN2C(C3C(N2C1)C(=O)N(C3=O)C4=CC(=C(C=C4)Cl)(N+)(=O)(O))C5=CC=C(C=C5)Br
InChI=1SC20H16BrClN4O4c21124211(3512)171618(2491823(17)24)20(28)25(19(16)27)136714(22)15(1013)26(29)30h27101618H189H2
MFCD03298493
ZINC000100874873
ZINC000239284724
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