Vitas-M small molecule compound

ethyl 4-{[4-methoxy-3-(pyrrolidin-1-ylcarbonyl)phenyl]sulfonyl}piperazine-1-carboxylate

Catalog ID
STL355093
SMILES CCOC(=O)N1CCN(CC1)S(=O)(=O)c1ccc(c(c1)C(=O)N1CCCC1)OC

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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 C19H27N3O6S MW 425.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H27N3O6S/c1-3-28-19(24)21-10-12-22(13-11-21)29(25,26)15-6-7-17(27-2)16(14-15)18(23)20-8-4-5-9-20/h6-7,14H,3-5,8-13H2,1-2H3
InChIKey
PDNNNWJQOJUFRV-UHFFFAOYSA-N
Synonyms

CCOC(=O)N1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)OC)C(=O)N3CCCC3
ethyl4((4methoxy3(pyrrolidin1ylcarbonyl)phenyl)sulfonyl)piperazine1carboxylate
ethyl4(4methoxy3(pyrrolidine1carbonyl)phenyl)sulfonylpiperazine1carboxylate
InChI=1SC19H27N3O6Sc132819(24)21101222(131121)29(2526)156717(272)16(1415)18(23)20845920h6714H35813H212H3
MFCD09440883
ZINC000008560330
ZINC8560330

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Available files

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