Vitas-M small molecule compound

2-(4-{[4-(2-hydroxyethyl)piperazin-1-yl]carbonothioyl}-2-methoxyphenoxy)acetamide

Catalog ID
STK617928
SMILES OCCN1CCN(CC1)C(=S)c1ccc(c(c1)OC)OCC(=O)N

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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 C16H23N3O4S MW 353.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H23N3O4S/c1-22-14-10-12(2-3-13(14)23-11-15(17)21)16(24)19-6-4-18(5-7-19)8-9-20/h2-3,10,20H,4-9,11H2,1H3,(H2,17,21)
InChIKey
LSXPCIHWWQXGSX-UHFFFAOYSA-N
Synonyms
951999-58-9
2(4((4(2hydroxyethyl)piperazin1yl)carbonothioyl)2methoxyphenoxy)acetamide
2(4(4(2hydroxyethyl)piperazine1carbonothioyl)2methoxyphenoxy)acetamide
2(4(4(2hydroxyethyl)piperazine1carbothioyl)2methoxyphenoxy)acetamide
951999589
COC1=C(C=CC(=C1)C(=S)N2CCN(CC2)CCO)OCC(=O)N
InChI=1SC16H23N3O4Sc122141012(2313(14)231115(17)21)16(24)196418(5719)8920h231020H4911H21H3(H21721)
MFCD09854385
ZINC000013718380
ZINC13718380

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Available files

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