Vitas-M small molecule compound
(6Z)-3-(3,4-dimethoxyphenyl)-6-(3-nitrobenzylidene)[1,3]thiazolo[2,3-c][1,2,4]triazol-5(6H)-one
Catalog ID
STK221373
SMILES COc1cc(ccc1OC)c1nnc2n1c(=O)/c(=C/c1cccc(c1)[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/c1-27-14-7-6-12(10-15(14)28-2)17-20-21-19-22(17)18(24)16(29-19)9-11-4-3-5-13(8-11)23(25)26/h3-10H,1-2H3/b16-9-InChIKey
HUXGEWJSDFCFBS-SXGWCWSVSA-NSynonyms
(6Z)3(34DIMETHOXYPHENYL)6((3NITROPHENYL)METHYLIDENE)(13)THIAZOLO(23C)(124)TRIAZOL5ONE
(6Z)3(34dimethoxyphenyl)6(3nitrobenzylidene)(13)thiazolo(23c)(124)triazol5(6H)one
(E)3(34dimethoxyphenyl)6(3nitrobenzylidene)thiazolo(23c)(124)triazol5(6H)one
COC1=C(C=C(C=C1)C2=NN=C3N2C(=O)C(=CC4=CC(=CC=C4)(N+)(=O)(O))S3)OC
COc1cc(ccc1OC)c1nnc2n1c(=O)c(=Cc1cccc(c1)(N+)(=O)(O))s2
InChI=1SC19H14N4O5Sc127147612(1015(14)282)1720211922(17)18(24)16(2919)91143513(811)23(25)26h310H12H3b169
MFCD08681978
ZINC000002409483
ZINC02409483
ZINC2409483
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