Vitas-M small molecule compound

(5E)-3-ethyl-5-(2-nitrobenzylidene)-1,3-thiazolidine-2,4-dione

Catalog ID
STK155295
SMILES CCN1C(=O)S/C(=C/c2ccccc2[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 C12H10N2O4S MW 278.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H10N2O4S/c1-2-13-11(15)10(19-12(13)16)7-8-5-3-4-6-9(8)14(17)18/h3-7H,2H2,1H3/b10-7+
InChIKey
AHGJZCVCYLTXKR-JXMROGBWSA-N
Synonyms

(5E)3ETHYL5((2NITROPHENYL)METHYLIDENE)13THIAZOLIDINE24DIONE
(5E)3ETHYL5(2NITROBENZYLIDENE)13THIAZOLIDINE24DIONE
CCN1C(=O)C(=CC2=CC=CC=C2(N+)(=O)(O))SC1=O
CCN1C(=O)SC(=Cc2ccccc2(N+)(=O)(O))C1=O
InChI=1SC12H10N2O4Sc121311(15)10(1912(13)16)7853469(8)14(17)18h37H2H21H3b107+
MFCD04522249
ZINC000004695304
ZINC04695304
ZINC4695304

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.