Vitas-M small molecule compound

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

Catalog ID
STK037258
SMILES CCc1ccc(cc1)N(S(=O)(=O)c1ccccc1)CC(=O)N1CCN(CC1)Cc1ccc2c(c1)OCO2

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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 C28H31N3O5S MW 521.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31N3O5S/c1-2-22-8-11-24(12-9-22)31(37(33,34)25-6-4-3-5-7-25)20-28(32)30-16-14-29(15-17-30)19-23-10-13-26-27(18-23)36-21-35-26/h3-13,18H,2,14-17,19-21H2,1H3
InChIKey
MFTHMZMGEASRQY-UHFFFAOYSA-N
Synonyms

CCC1=CC=C(C=C1)N(CC(=O)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4)S(=O)(=O)C5=CC=CC=C5
CCc1ccc(cc1)N(S(=O)(=O)c1ccccc1)CC(=O)N1CCN(CC1)Cc1ccc2c(c1)OCO2
InChI=1SC28H31N3O5Sc122281124(12922)31(37(3334)256435725)2028(32)30161429(151730)192310132627(1823)36213526h31318H214171921H21H3
MFCD03573441
N(2(4(13BENZODIOXOL5YLMETHYL)PIPERAZIN1YL)2OXOETHYL)N(4ETHYLPHENYL)BENZENESULFONAMIDE
STK037258
ZINC000020123524
ZINC20123524

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Available files

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