Vitas-M small molecule compound
2-(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)-1-[1-(4-ethoxyphenyl)-1,3,4,9-tetrahydro-2H-beta-carbolin-2-yl]ethanone
Catalog ID
STK959407
SMILES CCOc1ccc(cc1)C1N(CCc2c1[nH]c1c2cccc1)C(=O)Cn1nc(c(c1C)Br)[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 C25H24BrN5O4 MW 538.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24BrN5O4/c1-3-35-17-10-8-16(9-11-17)24-23-19(18-6-4-5-7-20(18)27-23)12-13-29(24)21(32)14-30-15(2)22(26)25(28-30)31(33)34/h4-11,24,27H,3,12-14H2,1-2H3InChIKey
MOWAKAYCKOMCST-UHFFFAOYSA-NSynonyms
489452-03-12(4bromo5methyl3nitro1Hpyrazol1yl)1(1(4ethoxyphenyl)1349tetrahydro2Hbetacarbolin2yl)ethanone
2(4bromo5methyl3nitropyrazol1yl)1(1(4ethoxyphenyl)1349tetrahydropyrido(34b)indol2yl)ethanone
489452031
CCOC1=CC=C(C=C1)C2C3=C(CCN2C(=O)CN4C(=C(C(=N4)(N+)(=O)(O))Br)C)C5=CC=CC=C5N3
CCOc1ccc(cc1)C1N(CCc2c1(nH)c1c2cccc1)C(=O)Cn1nc(c(c1C)Br)(N+)(=O)(O)
InChI=1SC25H24BrN5O4c13351710816(91117)242319(18645720(18)2723)121329(24)21(32)143015(2)22(26)25(2830)31(33)34h4112427H31214H212H3
MFCD02056286
ZINC000000681711
ZINC000000681712
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