Vitas-M small molecule compound

ethyl 4-[N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(methylsulfonyl)glycyl]piperazine-1-carboxylate

Catalog ID
STK188290
SMILES CCOC(=O)N1CCN(CC1)C(=O)CN(S(=O)(=O)C)c1ccc2c(c1)OCCO2

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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 C18H25N3O7S MW 427.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H25N3O7S/c1-3-26-18(23)20-8-6-19(7-9-20)17(22)13-21(29(2,24)25)14-4-5-15-16(12-14)28-11-10-27-15/h4-5,12H,3,6-11,13H2,1-2H3
InChIKey
HYAIRUANYZDWGQ-UHFFFAOYSA-N
Synonyms

CCOC(=O)N1CCN(CC1)C(=O)CN(C2=CC3=C(C=C2)OCCO3)S(=O)(=O)C
ETHYL4(2(23DIHYDRO14BENZODIOXIN6YL(METHYLSULFONYL)AMINO)ACETYL)PIPERAZINE1CARBOXYLATE
ETHYL4(N(23DIHYDRO14BENZODIOXIN6YL)N(METHYLSULFONYL)GLYCYL)PIPERAZINE1CARBOXYLATE
InChI=1SC18H25N3O7Sc132618(23)208619(7920)17(22)1321(29(224)25)14451516(1214)2811102715h4512H361113H212H3
MFCD04210898
ZINC000001140592
ZINC01140592
ZINC1140592

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Available files

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