Vitas-M small molecule compound
(5E)-3-methyl-5-[5-nitro-2-(pyridin-2-ylsulfanyl)benzylidene]-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STL428609
SMILES S=C1S/C(=C/c2cc(ccc2Sc2ccccn2)[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 C16H11N3O3S3 MW 389.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H11N3O3S3/c1-18-15(20)13(25-16(18)23)9-10-8-11(19(21)22)5-6-12(10)24-14-4-2-3-7-17-14/h2-9H,1H3/b13-9+InChIKey
KDAPLUHXECUNIF-UKTHLTGXSA-NSynonyms
(5E)3METHYL5((5NITRO2PYRIDIN2YLSULFANYLPHENYL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(5E)3methyl5(5nitro2(pyridin2ylsulfanyl)benzylidene)2thioxo13thiazolidin4one
CN1C(=O)C(=CC2=C(C=CC(=C2)(N+)(=O)(O))SC3=CC=CC=N3)SC1=S
InChI=1SC16H11N3O3S3c11815(20)13(2516(18)23)910811(19(21)22)5612(10)241442371714h29H1H3b139+
MFCD04084370
S=C1SC(=Cc2cc(ccc2Sc2ccccn2)(N+)(=O)(O))C(=O)N1C
ZINC000006273977
ZINC06273977
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