Vitas-M small molecule compound

9-ethyl-8-methyl-2-{5-[(2-nitrophenoxy)methyl]furan-2-yl}thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine

Catalog ID
STL178234
SMILES CCc1c(C)sc2c1c1nc(nn1cn2)c1ccc(o1)COc1ccccc1[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 C21H17N5O4S MW 435.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17N5O4S/c1-3-14-12(2)31-21-18(14)20-23-19(24-25(20)11-22-21)17-9-8-13(30-17)10-29-16-7-5-4-6-15(16)26(27)28/h4-9,11H,3,10H2,1-2H3
InChIKey
YBKGMZRDYQDEAE-UHFFFAOYSA-N
Synonyms
828284-52-2
828284522
9ethyl8methyl2(5((2nitrophenoxy)methyl)furan2yl)thieno(32e)(124)triazolo(15c)pyrimidine
CCC1=C(SC2=C1C3=NC(=NN3C=N2)C4=CC=C(O4)COC5=CC=CC=C5(N+)(=O)(O))C
CCc1c(C)sc2c1c1nc(nn1cn2)c1ccc(o1)COc1ccccc1(N+)(=O)(O)
InChI=1SC21H17N5O4Sc131412(2)312118(14)202319(2425(20)112221)179813(3017)102916754615(16)26(27)28h4911H310H212H3
MFCD04056473
ZINC000002791806
ZINC02791806
ZINC2791806

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Available files

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