Vitas-M small molecule compound
8-methoxy-4-[4-(4-nitrobenzyl)piperazin-1-yl]-5H-pyrimido[5,4-b]indole
Catalog ID
STK548448
SMILES COc1ccc2c(c1)c1ncnc(c1[nH]2)N1CCN(CC1)Cc1ccc(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 C22H22N6O3 MW 418.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N6O3/c1-31-17-6-7-19-18(12-17)20-21(25-19)22(24-14-23-20)27-10-8-26(9-11-27)13-15-2-4-16(5-3-15)28(29)30/h2-7,12,14,25H,8-11,13H2,1H3InChIKey
UOHYTEGFCCOMBW-UHFFFAOYSA-NSynonyms
866602-98-4866602984
8METHOXY4(4((4NITROPHENYL)METHYL)PIPERAZIN1YL)5HPYRIMIDO(54B)INDOLE
8methoxy4(4(4nitrobenzyl)piperazin1yl)5Hpyrimido(54b)indole
COC1=CC2=C(C=C1)NC3=C2N=CN=C3N4CCN(CC4)CC5=CC=C(C=C5)(N+)(=O)(O)
COc1ccc2c(c1)c1ncnc(c1(nH)2)N1CCN(CC1)Cc1ccc(cc1)(N+)(=O)(O)
InChI=1SC22H22N6O3c13117671918(1217)2021(2519)22(24142320)2710826(91127)13152416(5315)28(29)30h27121425H81113H21H3
MFCD03663782
ZINC000057063752
ZINC57063752
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