Vitas-M small molecule compound

ethyl 4-[(3-benzyl-2-oxo-2,3-dihydro-1,3-benzoxazol-6-yl)sulfonyl]piperazine-1-carboxylate

Catalog ID
STK983585
SMILES CCOC(=O)N1CCN(CC1)S(=O)(=O)c1ccc2c(c1)oc(=O)n2Cc1ccccc1

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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 C21H23N3O6S MW 445.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N3O6S/c1-2-29-20(25)22-10-12-23(13-11-22)31(27,28)17-8-9-18-19(14-17)30-21(26)24(18)15-16-6-4-3-5-7-16/h3-9,14H,2,10-13,15H2,1H3
InChIKey
YELANLJFHVBWNI-UHFFFAOYSA-N
Synonyms

CCOC(=O)N1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N(C(=O)O3)CC4=CC=CC=C4
ethyl4((3benzyl2oxo13benzoxazol6yl)sulfonyl)piperazine1carboxylate
ethyl4((3benzyl2oxo23dihydro13benzoxazol6yl)sulfonyl)piperazine1carboxylate
InChI=1SC21H23N3O6Sc122920(25)22101223(131122)31(2728)17891819(1417)3021(26)24(18)15166435716h3914H2101315H21H3
MFCD08847612
ZINC000011689675
ZINC11689675

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Available files

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