Vitas-M small molecule compound

methyl {3-[(E)-(4-hydroxy-2-oxo-1,3-thiazol-5(2H)-ylidene)methyl]-1H-indol-1-yl}acetate

Catalog ID
STK855733
SMILES COC(=O)Cn1cc(c2c1cccc2)/C=C\1/SC(=O)N=C1O

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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 C15H12N2O4S MW 316.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H12N2O4S/c1-21-13(18)8-17-7-9(10-4-2-3-5-11(10)17)6-12-14(19)16-15(20)22-12/h2-7H,8H2,1H3,(H,16,19,20)/b12-6+
InChIKey
DHQOBNAAGJUPJH-WUXMJOGZSA-N
Synonyms

(3(24DIOXOTHIAZOLIDIN5YLIDENEMETHYL)INDOL1YL)ACETICACIDMETHYLESTER
COC(=O)Cn1cc(c2c1cccc2)C=C1SC(=O)N=C1O
InChI=1SC15H12N2O4Sc12113(18)81779(10423511(10)17)61214(19)1615(20)2212h27H8H21H3(H161920)b126+
methyl(3((E)(4hydroxy2oxo13thiazol5(2H)ylidene)methyl)1Hindol1yl)acetate
METHYL2(3((E)(24DIOXO13THIAZOLIDIN5YLIDENE)METHYL)INDOL1YL)ACETATE
MFCD08735401
ZINC000008744273
ZINC08744273
ZINC8744273

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Available files

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