Vitas-M small molecule compound
methyl 3-({[4-(4-nitrobenzyl)piperazin-1-yl]acetyl}amino)-1H-indole-2-carboxylate
Catalog ID
STL345811
SMILES COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)Cc1ccc(cc1)[N+](=O)[O-])cccc2
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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 C23H25N5O5 MW 451.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25N5O5/c1-33-23(30)22-21(18-4-2-3-5-19(18)24-22)25-20(29)15-27-12-10-26(11-13-27)14-16-6-8-17(9-7-16)28(31)32/h2-9,24H,10-15H2,1H3,(H,25,29)InChIKey
PPGCODHGENPNLK-UHFFFAOYSA-NSynonyms
384803-55-8384803558
COC(=O)c1(nH)c2c(c1NC(=O)CN1CCN(CC1)Cc1ccc(cc1)(N+)(=O)(O))cccc2
COC(=O)C1=C(C2=CC=CC=C2N1)NC(=O)CN3CCN(CC3)CC4=CC=C(C=C4)(N+)(=O)(O)
InChI=1SC23H25N5O5c13323(30)2221(18423519(18)2422)2520(29)1527121026(111327)14166817(9716)28(31)32h2924H1015H21H3(H2529)
methyl3(((4(4nitrobenzyl)piperazin1yl)acetyl)amino)1Hindole2carboxylate
METHYL3((2(4((4NITROPHENYL)METHYL)PIPERAZIN1YL)ACETYL)AMINO)1HINDOLE2CARBOXYLATE
methyl3(2(4(4nitrobenzyl)piperazin1yl)acetamido)1Hindole2carboxylate
MFCD01565418
ZINC000095482904
ZINC95482904
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