Vitas-M small molecule compound

5-{[(2Z)-3-(1,3-benzodioxol-5-ylmethyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]amino}-5-oxopentanoic acid

Catalog ID
STK573493
SMILES OC(=O)CCCC(=O)/N=C/1\SC2C(N1Cc1ccc3c(c1)OCO3)CS(=O)(=O)C2

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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 C18H20N2O7S2 MW 440.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N2O7S2/c21-16(2-1-3-17(22)23)19-18-20(12-8-29(24,25)9-15(12)28-18)7-11-4-5-13-14(6-11)27-10-26-13/h4-6,12,15H,1-3,7-10H2,(H,22,23)/b19-18-
InChIKey
LXMDAINMXWRSPQ-HNENSFHCSA-N
Synonyms
900261-66-7
(Z)5((3(benzo(d)(13)dioxol5ylmethyl)55dioxidotetrahydrothieno(34d)thiazol2(3H)ylidene)amino)5oxopentanoicacid
5(((2Z)3(13benzodioxol5ylmethyl)55dioxidotetrahydrothieno(34d)(13)thiazol2(3H)ylidene)amino)5oxopentanoicacid
900261667
MFCD06610672
OC(=O)CCCC(=O)N=C1SC2C(N1Cc1ccc3c(c1)OCO3)CS(=O)(=O)C2
ZINC000009237272
ZINC000009237281

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Available files

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