Vitas-M small molecule compound
(5Z)-2-(3,4-dimethoxyphenyl)-5-(4-nitrobenzylidene)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK800909
SMILES COc1ccc(cc1OC)c1nc2n(n1)c(=O)/c(=C/c1ccc(cc1)[N+](=O)[O-])/s2
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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 C19H14N4O5S MW 410.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H14N4O5S/c1-27-14-8-5-12(10-15(14)28-2)17-20-19-22(21-17)18(24)16(29-19)9-11-3-6-13(7-4-11)23(25)26/h3-10H,1-2H3/b16-9-InChIKey
IMXHGNYOPSCZAK-SXGWCWSVSA-NSynonyms
573669-17-7(5Z)2(34DIMETHOXYPHENYL)5((4NITROPHENYL)METHYLIDENE)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(5Z)2(34dimethoxyphenyl)5(4nitrobenzylidene)(13)thiazolo(32b)(124)triazol6(5H)one
(Z)2(34dimethoxyphenyl)5(4nitrobenzylidene)thiazolo(32b)(124)triazol6(5H)one
573669177
COC1=C(C=C(C=C1)C2=NN3C(=O)C(=CC4=CC=C(C=C4)(N+)(=O)(O))SC3=N2)OC
COc1ccc(cc1OC)c1nc2n(n1)c(=O)c(=Cc1ccc(cc1)(N+)(=O)(O))s2
InChI=1SC19H14N4O5Sc127148512(1015(14)282)17201922(2117)18(24)16(2919)9113613(7411)23(25)26h310H12H3b169
MFCD04017339
ZINC000001316691
ZINC01316691
ZINC1316691
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