Vitas-M small molecule compound

(5E)-3-ethyl-5-{3-methoxy-4-[(5-nitropyridin-2-yl)oxy]benzylidene}-1,3-thiazolidine-2,4-dione

Catalog ID
STK152761
SMILES CCN1C(=O)S/C(=C/c2ccc(c(c2)OC)Oc2ccc(cn2)[N+](=O)[O-])/C1=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 C18H15N3O6S MW 401.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15N3O6S/c1-3-20-17(22)15(28-18(20)23)9-11-4-6-13(14(8-11)26-2)27-16-7-5-12(10-19-16)21(24)25/h4-10H,3H2,1-2H3/b15-9+
InChIKey
KHKHYPSATLEMPE-OQLLNIDSSA-N
Synonyms

(5E)3ETHYL5((3METHOXY4(5NITROPYRIDIN2YL)OXYPHENYL)METHYLIDENE)13THIAZOLIDINE24DIONE
(5E)3ETHYL5(3METHOXY4((5NITROPYRIDIN2YL)OXY)BENZYLIDENE)13THIAZOLIDINE24DIONE
3ETHYL5(3METHOXY4((5NITRO2PYRIDINYL)OXY)BENZYLIDENE)13THIAZOLIDINE24DIONE
3ETHYL5(4((5NITRO2PYRIDINYL)OXY)3METHOXYBENZYLIDENE)13THIAZOLIDINE24DIONE
CCN1C(=O)C(=CC2=CC(=C(C=C2)OC3=NC=C(C=C3)(N+)(=O)(O))OC)SC1=O
CCN1C(=O)SC(=Cc2ccc(c(c2)OC)Oc2ccc(cn2)(N+)(=O)(O))C1=O
InChI=1SC18H15N3O6Sc132017(22)15(2818(20)23)9114613(14(811)262)27167512(101916)21(24)25h410H3H212H3b159+
MFCD03722397
ZINC000004457188
ZINC04457188
ZINC4457188

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Available files

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