Vitas-M small molecule compound

N-{2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-oxoethyl}-N-cyclohexylmethanesulfonamide

Catalog ID
STK138521
SMILES O=C(N1CCN(CC1)Cc1ccc2c(c1)OCO2)CN(S(=O)(=O)C)C1CCCCC1

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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 C21H31N3O5S MW 437.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H31N3O5S/c1-30(26,27)24(18-5-3-2-4-6-18)15-21(25)23-11-9-22(10-12-23)14-17-7-8-19-20(13-17)29-16-28-19/h7-8,13,18H,2-6,9-12,14-16H2,1H3
InChIKey
FZBFDVYQRFLKAA-UHFFFAOYSA-N
Synonyms

CS(=O)(=O)N(CC(=O)N1CCN(CC1)CC2=CC3=C(C=C2)OCO3)C4CCCCC4
InChI=1SC21H31N3O5Sc130(2627)24(185324618)1521(25)2311922(101223)1417781920(1317)29162819h781318H269121416H21H3
MFCD04362168
N(2(4(13BENZODIOXOL5YLMETHYL)PIPERAZIN1YL)2OXOETHYL)NCYCLOHEXYLMETHANESULFONAMIDE
ZINC000013108203
ZINC13108203

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Available files

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