Vitas-M small molecule compound

methyl 4-{(Z)-[3-(1-ethoxy-1-oxopropan-2-yl)-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl}benzoate

Catalog ID
STK157827
SMILES CCOC(=O)C(N1C(=O)S/C(=C\c2ccc(cc2)C(=O)OC)/C1=O)C

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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 C17H17NO6S MW 363.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17NO6S/c1-4-24-15(20)10(2)18-14(19)13(25-17(18)22)9-11-5-7-12(8-6-11)16(21)23-3/h5-10H,4H2,1-3H3/b13-9-
InChIKey
GBKLANZOISYIAF-LCYFTJDESA-N
Synonyms

CCOC(=O)C(C)N1C(=O)C(=CC2=CC=C(C=C2)C(=O)OC)SC1=O
CCOC(=O)C(N1C(=O)SC(=Cc2ccc(cc2)C(=O)OC)C1=O)C
InChI=1SC17H17NO6Sc142415(20)10(2)1814(19)13(2517(18)22)9115712(8611)16(21)233h510H4H213H3b139
METHYL4((Z)(3(1ETHOXY1OXOPROPAN2YL)24DIOXO13THIAZOLIDIN5YLIDENE)METHYL)BENZOATE
MFCD06663099
ZINC000001161013
ZINC000001161015

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Available files

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