Vitas-M small molecule compound

3,4-dimethoxy-N-[(2E)-6-(pyrrolidin-1-ylsulfonyl)-1,3-benzothiazol-2(3H)-ylidene]benzamide

Catalog ID
STK851182
SMILES COc1cc(ccc1OC)C(=O)/N=c\1/sc2c([nH]1)ccc(c2)S(=O)(=O)N1CCCC1

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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 C20H21N3O5S2 MW 447.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N3O5S2/c1-27-16-8-5-13(11-17(16)28-2)19(24)22-20-21-15-7-6-14(12-18(15)29-20)30(25,26)23-9-3-4-10-23/h5-8,11-12H,3-4,9-10H2,1-2H3,(H,21,22,24)
InChIKey
CPMFSXAPMRSVKC-UHFFFAOYSA-N
Synonyms
692746-03-5
692746035
COc1cc(ccc1OC)C(=O)N=c1sc2c((nH)1)ccc(c2)S(=O)(=O)N1CCCC1
MFCD07203580
ZINC000009087179

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Available files

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