Vitas-M small molecule compound
8-ethoxy-4-[4-(4-nitrophenyl)piperazin-1-yl]-5H-pyrimido[5,4-b]indole
Catalog ID
STL042246
SMILES CCOc1ccc2c(c1)c1ncnc(c1[nH]2)N1CCN(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 C22H22N6O3 MW 418.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N6O3/c1-2-31-17-7-8-19-18(13-17)20-21(25-19)22(24-14-23-20)27-11-9-26(10-12-27)15-3-5-16(6-4-15)28(29)30/h3-8,13-14,25H,2,9-12H2,1H3InChIKey
DPIAVDJGGCSEOF-UHFFFAOYSA-NSynonyms
714289-36-8714289368
8ethoxy4(4(4nitrophenyl)piperazin1yl)5Hpyrimido(54b)indole
CCOC1=CC2=C(C=C1)NC3=C2N=CN=C3N4CCN(CC4)C5=CC=C(C=C5)(N+)(=O)(O)
CCOc1ccc2c(c1)c1ncnc(c1(nH)2)N1CCN(CC1)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC22H22N6O3c123117781918(1317)2021(2519)22(24142320)2711926(101227)153516(6415)28(29)30h38131425H2912H21H3
MFCD04194953
ZINC000005249682
ZINC05249682
ZINC5249682
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