Vitas-M small molecule compound
1-{2-[3-(4-bromophenyl)-5-phenyl-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-5-(4-ethylphenyl)-3a,6a-dihydropyrrolo[3,4-d][1,2,3]triazole-4,6(1H,5H)-dione
Catalog ID
STK305061
SMILES CCc1ccc(cc1)N1C(=O)C2C(C1=O)N(N=N2)CC(=O)N1N=C(CC1c1ccccc1)c1ccc(cc1)Br
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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 C29H25BrN6O3 MW 585.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H25BrN6O3/c1-2-18-8-14-22(15-9-18)35-28(38)26-27(29(35)39)34(33-31-26)17-25(37)36-24(20-6-4-3-5-7-20)16-23(32-36)19-10-12-21(30)13-11-19/h3-15,24,26-27H,2,16-17H2,1H3InChIKey
ZVDPUOPDUMAJCJ-UHFFFAOYSA-NSynonyms
1024310-93-71(2(3(4bromophenyl)5phenyl45dihydro1Hpyrazol1yl)2oxoethyl)5(4ethylphenyl)3a6adihydropyrrolo(34d)(123)triazole46(1H5H)dione
1024310937
3(2(5(4BROMOPHENYL)3PHENYL34DIHYDROPYRAZOL2YL)2OXOETHYL)5(4ETHYLPHENYL)3A6ADIHYDROPYRROLO(34D)TRIAZOLE46DIONE
CCC1=CC=C(C=C1)N2C(=O)C3C(C2=O)N(N=N3)CC(=O)N4C(CC(=N4)C5=CC=C(C=C5)Br)C6=CC=CC=C6
InChI=1SC29H25BrN6O3c121881422(15918)3528(38)2627(29(35)39)34(333126)1725(37)3624(206435720)1623(3236)19101221(30)131119h315242627H21617H21H3
MFCD04049512
ZINC000098046027
ZINC000103152328
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