Vitas-M small molecule compound

methyl 4-[2-oxo-2-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylamino)ethoxy]benzoate

Catalog ID
STK754151
SMILES COC(=O)c1ccc(cc1)OCC(=O)Nc1nc2c(s1)CCCC2

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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 C17H18N2O4S MW 346.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18N2O4S/c1-22-16(21)11-6-8-12(9-7-11)23-10-15(20)19-17-18-13-4-2-3-5-14(13)24-17/h6-9H,2-5,10H2,1H3,(H,18,19,20)
InChIKey
JSRVALZWBDMVCZ-UHFFFAOYSA-N
Synonyms

COC(=O)C1=CC=C(C=C1)OCC(=O)NC2=NC3=C(S2)CCCC3
InChI=1SC17H18N2O4Sc12216(21)116812(9711)231015(20)19171813423514(13)2417h69H2510H21H3(H181920)
methyl4(2oxo2(4567tetrahydro13benzothiazol2ylamino)ethoxy)benzoate
MFCD00825211
ZINC000000051105
ZINC00051105
ZINC51105

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Available files

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