Vitas-M small molecule compound
(5E)-5-(4-chloro-3-nitrobenzylidene)-3-(3,4-dimethylphenyl)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STL419095
SMILES S=C1S/C(=C/c2ccc(c(c2)[N+](=O)[O-])Cl)/C(=O)N1c1ccc(c(c1)C)C
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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 C18H13ClN2O3S2 MW 404.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13ClN2O3S2/c1-10-3-5-13(7-11(10)2)20-17(22)16(26-18(20)25)9-12-4-6-14(19)15(8-12)21(23)24/h3-9H,1-2H3/b16-9+InChIKey
HMDRCUHCWCRVGQ-CXUHLZMHSA-NSynonyms
(5E)5((4CHLORO3NITROPHENYL)METHYLIDENE)3(34DIMETHYLPHENYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
(5E)5(4chloro3nitrobenzylidene)3(34dimethylphenyl)2thioxo13thiazolidin4one
CC1=C(C=C(C=C1)N2C(=O)C(=CC3=CC(=C(C=C3)Cl)(N+)(=O)(O))SC2=S)C
InChI=1SC18H13ClN2O3S2c1103513(711(10)2)2017(22)16(2618(20)25)9124614(19)15(812)21(23)24h39H12H3b169+
MFCD03614105
S=C1SC(=Cc2ccc(c(c2)(N+)(=O)(O))Cl)C(=O)N1c1ccc(c(c1)C)C
ZINC000009187038
ZINC09187038
ZINC9187038
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