Vitas-M small molecule compound

(3-{(E)-[3-(2-methoxy-2-oxoethyl)-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl}-1H-indol-1-yl)acetic acid

Catalog ID
STK037971
SMILES COC(=O)CN1C(=O)S/C(=C/c2cn(c3c2cccc3)CC(=O)O)/C1=O

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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 C17H14N2O6S MW 374.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14N2O6S/c1-25-15(22)9-19-16(23)13(26-17(19)24)6-10-7-18(8-14(20)21)12-5-3-2-4-11(10)12/h2-7H,8-9H2,1H3,(H,20,21)/b13-6+
InChIKey
FUGIJHMCGBQTNH-AWNIVKPZSA-N
Synonyms
586993-83-1
(3((E)(3(2METHOXY2OXOETHYL)24DIOXO13THIAZOLIDIN5YLIDENE)METHYL)1HINDOL1YL)ACETICACID
(E)2(3((3(2methoxy2oxoethyl)24dioxothiazolidin5ylidene)methyl)1Hindol1yl)aceticacid
2(3((E)(3(2METHOXY2OXOETHYL)24DIOXO13THIAZOLIDIN5YLIDENE)METHYL)INDOL1YL)ACETICACID
586993831
COC(=O)CN1C(=O)C(=CC2=CN(C3=CC=CC=C32)CC(=O)O)SC1=O
COC(=O)CN1C(=O)SC(=Cc2cn(c3c2cccc3)CC(=O)O)C1=O
InChI=1SC17H14N2O6Sc12515(22)91916(23)13(2617(19)24)610718(814(20)21)12532411(10)12h27H89H21H3(H2021)b136+
MFCD04033474
STK037971
ZINC000004608227
ZINC4608227

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Available files

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