Vitas-M small molecule compound

ethyl [(2Z)-2-{[3-(1,1-dioxido-3-oxo-1,2-benzothiazol-2(3H)-yl)propanoyl]imino}-2,3-dihydro-1,3-thiazol-4-yl]acetate

Catalog ID
STL250446
SMILES CCOC(=O)Cc1cs/c(=N\C(=O)CCN2C(=O)c3c(S2(=O)=O)cccc3)/[nH]1

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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 C17H17N3O6S2 MW 423.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17N3O6S2/c1-2-26-15(22)9-11-10-27-17(18-11)19-14(21)7-8-20-16(23)12-5-3-4-6-13(12)28(20,24)25/h3-6,10H,2,7-9H2,1H3,(H,18,19,21)
InChIKey
MEDGYRFXYRHZAJ-UHFFFAOYSA-N
Synonyms
899757-59-6
899757596
CCOC(=O)Cc1csc(=NC(=O)CCN2C(=O)c3c(S2(=O)=O)cccc3)(nH)1
ethyl((2Z)2((3(11dioxido3oxo12benzothiazol2(3H)yl)propanoyl)imino)23dihydro13thiazol4yl)acetate
ETHYL2(2(3(11DIOXIDO3OXOBENZO(D)ISOTHIAZOL2(3H)YL)PROPANAMIDO)THIAZOL4YL)ACETATE
MFCD24852347
ZINC000010188053
ZINC10188053

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Available files

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