Vitas-M small molecule compound

N-[(2Z)-3-(1,3-benzodioxol-5-ylmethyl)-4-(4-nitrophenyl)-1,3-thiazol-2(3H)-ylidene]aniline

Catalog ID
STK759064
SMILES [O-][N+](=O)c1ccc(cc1)c1cs/c(=N\c2ccccc2)/n1Cc1ccc2c(c1)OCO2

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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 C23H17N3O4S MW 431.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H17N3O4S/c27-26(28)19-9-7-17(8-10-19)20-14-31-23(24-18-4-2-1-3-5-18)25(20)13-16-6-11-21-22(12-16)30-15-29-21/h1-12,14H,13,15H2/b24-23-
InChIKey
XDONWYFTIWECGU-VHXPQNKSSA-N
Synonyms

(O)(N+)(=O)c1ccc(cc1)c1csc(=Nc2ccccc2)n1Cc1ccc2c(c1)OCO2
MFCD01460666
N((2Z)3(13benzodioxol5ylmethyl)4(4nitrophenyl)13thiazol2(3H)ylidene)aniline
ZINC000012375834

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Available files

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