Vitas-M small molecule compound
(5E)-3-methyl-5-{2-[2-(2-methylphenoxy)ethoxy]-5-nitrobenzylidene}-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK056181
SMILES S=C1S/C(=C/c2cc(ccc2OCCOc2ccccc2C)[N+](=O)[O-])/C(=O)N1C
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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 C20H18N2O5S2 MW 430.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N2O5S2/c1-13-5-3-4-6-16(13)26-9-10-27-17-8-7-15(22(24)25)11-14(17)12-18-19(23)21(2)20(28)29-18/h3-8,11-12H,9-10H2,1-2H3/b18-12+InChIKey
DUFPWCBFRMPZFG-LDADJPATSA-NSynonyms
(5E)3methyl5((2(2(2methylphenoxy)ethoxy)5nitrophenyl)methylidene)2sulfanylidene13thiazolidin4one
(5E)3METHYL5(2(2(2METHYLPHENOXY)ETHOXY)5NITROBENZYLIDENE)2THIOXO13THIAZOLIDIN4ONE
3METHYL5((2(2(2METHYLPHENOXY)ETHOXY)5NITROPHENYL)METHYLENE)2THIOXO13THIAZOLIDIN4ONE
CC1=CC=CC=C1OCCOC2=C(C=C(C=C2)(N+)(=O)(O))C=C3C(=O)N(C(=S)S3)C
InChI=1SC20H18N2O5S2c113534616(13)2691027178715(22(24)25)1114(17)121819(23)21(2)20(28)2918h381112H910H212H3b1812+
MFCD02120815
S=C1SC(=Cc2cc(ccc2OCCOc2ccccc2C)(N+)(=O)(O))C(=O)N1C
STK056181
ZINC000008861542
ZINC08861542
ZINC8861542
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