Vitas-M small molecule compound

tert-butyl 4-[4-(methylsulfanyl)-2-(1H-pyrrol-1-yl)butanoyl]piperazine-1-carboxylate

Catalog ID
STL493249
SMILES CSCCC(C(=O)N1CCN(CC1)C(=O)OC(C)(C)C)n1cccc1

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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 C18H29N3O3S MW 367.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H29N3O3S/c1-18(2,3)24-17(23)21-12-10-20(11-13-21)16(22)15(7-14-25-4)19-8-5-6-9-19/h5-6,8-9,15H,7,10-14H2,1-4H3
InChIKey
WWYILDDCFVQIND-UHFFFAOYSA-N
Synonyms

(R)tertbutyl4(4(methylthio)2(1Hpyrrol1yl)butanoyl)piperazine1carboxylate
CSCC(C@H)(C(=O)N1CCN(CC1)C(=O)OC(C)(C)C)n1cccc1
MFCD30715664
tertbutyl4(4(methylsulfanyl)2(1Hpyrrol1yl)butanoyl)piperazine1carboxylate
ZINC000263588670
ZINC000575443309

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Available files

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