Vitas-M small molecule compound

ethyl (2Z)-2-{[3-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)propanoyl]imino}-2,3-dihydro-1,3-thiazole-4-carboxylate

Catalog ID
STL161357
SMILES CCOC(=O)c1cs/c(=N\C(=O)CCN2Cc3c(C2=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 C17H17N3O4S MW 359.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17N3O4S/c1-2-24-16(23)13-10-25-17(18-13)19-14(21)7-8-20-9-11-5-3-4-6-12(11)15(20)22/h3-6,10H,2,7-9H2,1H3,(H,18,19,21)
InChIKey
WIHKPTDHHHSKBL-UHFFFAOYSA-N
Synonyms
1310945-73-3
1310945733
CCOC(=O)C1=CSC(=N1)NC(=O)CCN2CC3=CC=CC=C3C2=O
CCOC(=O)c1csc(=NC(=O)CCN2Cc3c(C2=O)cccc3)(nH)1
ethyl(2Z)2((3(1oxo13dihydro2Hisoindol2yl)propanoyl)imino)23dihydro13thiazole4carboxylate
ethyl2(3(3oxo1Hisoindol2yl)propanoylamino)13thiazole4carboxylate
InChI=1SC17H17N3O4Sc122416(23)13102517(1813)1914(21)7820911534612(11)15(20)22h3610H279H21H3(H181921)
MFCD20759352
ZINC000071281002
ZINC71281002

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Available files

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