Vitas-M small molecule compound
dimethyl 1-(2,4-dibromophenyl)-3-(4-nitrophenyl)-4,5-dihydro-1H-pyrazole-4,5-dicarboxylate
Catalog ID
STK668865
SMILES COC(=O)C1C(=NN(C1C(=O)OC)c1ccc(cc1Br)Br)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 C19H15Br2N3O6 MW 541.15 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H15Br2N3O6/c1-29-18(25)15-16(10-3-6-12(7-4-10)24(27)28)22-23(17(15)19(26)30-2)14-8-5-11(20)9-13(14)21/h3-9,15,17H,1-2H3InChIKey
HIWYADZTSABTQO-UHFFFAOYSA-NSynonyms
COC(=O)C1C(=NN(C1C(=O)OC)c1ccc(cc1Br)Br)c1ccc(cc1)(N+)(=O)(O)
COC(=O)C1C(N(N=C1C2=CC=C(C=C2)(N+)(=O)(O))C3=C(C=C(C=C3)Br)Br)C(=O)OC
dimethyl1(24dibromophenyl)3(4nitrophenyl)45dihydro1Hpyrazole45dicarboxylate
DIMETHYL2(24DIBROMOPHENYL)5(4NITROPHENYL)34DIHYDROPYRAZOLE34DICARBOXYLATE
InChI=1SC19H15Br2N3O6c12918(25)1516(103612(7410)24(27)28)2223(17(15)19(26)302)148511(20)913(14)21h391517H12H3
METHYL1(24DIBROMOPHENYL)4(METHOXYCARBONYL)3(4NITROPHENYL)2PYRAZOLINE5CARBOXYLATE
MFCD00742482
ZINC000100027114
ZINC000100027129
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