Vitas-M small molecule compound

N-[(2E)-5-cyclopentyl-1,3,4-thiadiazol-2(3H)-ylidene]-2-(2-methoxyphenoxy)acetamide

Catalog ID
STL041761
SMILES COc1ccccc1OCC(=O)/N=c/1\[nH]nc(s1)C1CCCC1

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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 C16H19N3O3S MW 333.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H19N3O3S/c1-21-12-8-4-5-9-13(12)22-10-14(20)17-16-19-18-15(23-16)11-6-2-3-7-11/h4-5,8-9,11H,2-3,6-7,10H2,1H3,(H,17,19,20)
InChIKey
MZIWXRLLTCXIMD-UHFFFAOYSA-N
Synonyms

COC1=CC=CC=C1OCC(=O)NC2=NN=C(S2)C3CCCC3
COc1ccccc1OCC(=O)N=c1(nH)nc(s1)C1CCCC1
InChI=1SC16H19N3O3Sc12112845913(12)221014(20)1716191815(2316)11623711h458911H236710H21H3(H171920)
MFCD05733112
N((2E)5cyclopentyl134thiadiazol2(3H)ylidene)2(2methoxyphenoxy)acetamide
N(5CYCLOPENTYL134THIADIAZOL2YL)2(2METHOXYPHENOXY)ACETAMIDE
ZINC000001272182
ZINC01272182
ZINC1272182

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Available files

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