Vitas-M small molecule compound

N-[(2E)-5-(3,4-dimethoxyphenyl)-1,3,4-thiadiazol-2(3H)-ylidene]-3-ethoxybenzamide

Catalog ID
STL053773
SMILES CCOc1cccc(c1)C(=O)/N=c/1\[nH]nc(s1)c1ccc(c(c1)OC)OC

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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 C19H19N3O4S MW 385.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19N3O4S/c1-4-26-14-7-5-6-12(10-14)17(23)20-19-22-21-18(27-19)13-8-9-15(24-2)16(11-13)25-3/h5-11H,4H2,1-3H3,(H,20,22,23)
InChIKey
MTTJYBPTBCMRDL-UHFFFAOYSA-N
Synonyms
714942-00-4
714942004
CCOc1cccc(c1)C(=O)N=c1(nH)nc(s1)c1ccc(c(c1)OC)OC
MFCD05736296
ZINC000005478609

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Available files

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