Vitas-M small molecule compound
4-[(2-bromo-6-methoxy-4-{(Z)-[3-(2-nitrobenzyl)-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl}phenoxy)methyl]benzonitrile
Catalog ID
STL378980
SMILES N#Cc1ccc(cc1)COc1c(Br)cc(cc1OC)/C=C/1\SC(=O)N(C1=O)Cc1ccccc1[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 C26H18BrN3O6S MW 580.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H18BrN3O6S/c1-35-22-11-18(10-20(27)24(22)36-15-17-8-6-16(13-28)7-9-17)12-23-25(31)29(26(32)37-23)14-19-4-2-3-5-21(19)30(33)34/h2-12H,14-15H2,1H3/b23-12-InChIKey
UWMWIUKAAPOIJT-FMCGGJTJSA-NSynonyms
4((2bromo6methoxy4((Z)(3((2nitrophenyl)methyl)24dioxo13thiazolidin5ylidene)methyl)phenoxy)methyl)benzonitrile
4((2bromo6methoxy4((Z)(3(2nitrobenzyl)24dioxo13thiazolidin5ylidene)methyl)phenoxy)methyl)benzonitrile
COC1=C(C(=CC(=C1)C=C2C(=O)N(C(=O)S2)CC3=CC=CC=C3(N+)(=O)(O))Br)OCC4=CC=C(C=C4)C#N
InChI=1SC26H18BrN3O6Sc135221118(1020(27)24(22)3615178616(1328)7917)122325(31)29(26(32)3723)1419423521(19)30(33)34h212H1415H21H3b2312
MFCD28951008
N#Cc1ccc(cc1)COc1c(Br)cc(cc1OC)C=C1SC(=O)N(C1=O)Cc1ccccc1(N+)(=O)(O)
ZINC000105979349
ZINC105979349
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