Vitas-M small molecule compound
(5Z)-5-(2-nitrobenzylidene)-2-(3,4,5-trimethoxyphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK799808
SMILES COc1cc(cc(c1OC)OC)c1nn2c(n1)s/c(=C\c1ccccc1[N+](=O)[O-])/c2=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 C20H16N4O6S MW 440.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16N4O6S/c1-28-14-8-12(9-15(29-2)17(14)30-3)18-21-20-23(22-18)19(25)16(31-20)10-11-6-4-5-7-13(11)24(26)27/h4-10H,1-3H3/b16-10-InChIKey
YFNWKADXYXAXKY-YBEGLDIGSA-NSynonyms
586996-72-7(5Z)5((2NITROPHENYL)METHYLIDENE)2(345TRIMETHOXYPHENYL)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(5Z)5(2nitrobenzylidene)2(345trimethoxyphenyl)(13)thiazolo(32b)(124)triazol6(5H)one
(Z)5(2nitrobenzylidene)2(345trimethoxyphenyl)thiazolo(32b)(124)triazol6(5H)one
586996727
COC1=CC(=CC(=C1OC)OC)C2=NN3C(=O)C(=CC4=CC=CC=C4(N+)(=O)(O))SC3=N2
COc1cc(cc(c1OC)OC)c1nn2c(n1)sc(=Cc1ccccc1(N+)(=O)(O))c2=O
InChI=1SC20H16N4O6Sc12814812(915(292)17(14)303)18212023(2218)19(25)16(3120)1011645713(11)24(26)27h410H13H3b1610
MFCD04031278
ZINC000001900411
ZINC01900411
ZINC1900411
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