Vitas-M small molecule compound
1-{2-[3-(4-bromophenyl)-5-phenyl-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-5-(4-nitrophenyl)-3a,6a-dihydropyrrolo[3,4-d][1,2,3]triazole-4,6(1H,5H)-dione
Catalog ID
STK305024
SMILES Brc1ccc(cc1)C1=NN(C(C1)c1ccccc1)C(=O)CN1N=NC2C1C(=O)N(C2=O)c1ccc(cc1)[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 C27H20BrN7O5 MW 602.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H20BrN7O5/c28-18-8-6-16(7-9-18)21-14-22(17-4-2-1-3-5-17)34(30-21)23(36)15-32-25-24(29-31-32)26(37)33(27(25)38)19-10-12-20(13-11-19)35(39)40/h1-13,22,24-25H,14-15H2InChIKey
FVMDOKZVFGOTOU-UHFFFAOYSA-NSynonyms
1024232-49-21(2(3(4bromophenyl)5phenyl45dihydro1Hpyrazol1yl)2oxoethyl)5(4nitrophenyl)3a6adihydropyrrolo(34d)(123)triazole46(1H5H)dione
1024232492
3(2(5(4BROMOPHENYL)3PHENYL34DIHYDROPYRAZOL2YL)2OXOETHYL)5(4NITROPHENYL)3A6ADIHYDROPYRROLO(34D)TRIAZOLE46DIONE
Brc1ccc(cc1)C1=NN(C(C1)c1ccccc1)C(=O)CN1N=NC2C1C(=O)N(C2=O)c1ccc(cc1)(N+)(=O)(O)
C1C(N(N=C1C2=CC=C(C=C2)Br)C(=O)CN3C4C(C(=O)N(C4=O)C5=CC=C(C=C5)(N+)(=O)(O))N=N3)C6=CC=CC=C6
InChI=1SC27H20BrN7O5c28188616(7918)211422(174213517)34(3021)23(36)15322524(293132)26(37)33(27(25)38)19101220(131119)35(39)40h113222425H1415H2
MFCD04049513
ZINC000103152277
ZINC000229872757
Check stock
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Check stock on Vitas-MAvailable files
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