Vitas-M small molecule compound
7-methoxy-4-[4-(4-nitrophenyl)piperazin-1-yl]-5H-pyrimido[5,4-b]indole
Catalog ID
STL050858
SMILES COc1ccc2c(c1)[nH]c1c2ncnc1N1CCN(CC1)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 C21H20N6O3 MW 404.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N6O3/c1-30-16-6-7-17-18(12-16)24-20-19(17)22-13-23-21(20)26-10-8-25(9-11-26)14-2-4-15(5-3-14)27(28)29/h2-7,12-13,24H,8-11H2,1H3InChIKey
MRLQJCYFPWQTJI-UHFFFAOYSA-NSynonyms
714241-10-8714241108
7methoxy4(4(4nitrophenyl)piperazin1yl)5Hpyrimido(54b)indole
COC1=CC2=C(C=C1)C3=C(N2)C(=NC=N3)N4CCN(CC4)C5=CC=C(C=C5)(N+)(=O)(O)
COc1ccc2c(c1)(nH)c1c2ncnc1N1CCN(CC1)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC21H20N6O3c13016671718(1216)242019(17)22132321(20)2610825(91126)142415(5314)27(28)29h27121324H811H21H3
MFCD04169702
ZINC000005183777
ZINC05183777
ZINC5183777
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