Vitas-M small molecule compound

ethyl 4-{[4-methyl-3-(pyrrolidin-1-ylsulfonyl)phenyl]carbonyl}piperazine-1-carboxylate

Catalog ID
STL384476
SMILES CCOC(=O)N1CCN(CC1)C(=O)c1ccc(c(c1)S(=O)(=O)N1CCCC1)C

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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 C19H27N3O5S MW 409.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H27N3O5S/c1-3-27-19(24)21-12-10-20(11-13-21)18(23)16-7-6-15(2)17(14-16)28(25,26)22-8-4-5-9-22/h6-7,14H,3-5,8-13H2,1-2H3
InChIKey
NLIGLYJAIRBCMY-UHFFFAOYSA-N
Synonyms

CCOC(=O)N1CCN(CC1)C(=O)C2=CC(=C(C=C2)C)S(=O)(=O)N3CCCC3
ethyl4((4methyl3(pyrrolidin1ylsulfonyl)phenyl)carbonyl)piperazine1carboxylate
ETHYL4(4METHYL3PYRROLIDIN1YLSULFONYLBENZOYL)PIPERAZINE1CARBOXYLATE
InChI=1SC19H27N3O5Sc132719(24)21121020(111321)18(23)167615(2)17(1416)28(2526)22845922h6714H35813H212H3
MFCD18487529
ZINC000007881083
ZINC7881083

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Available files

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