Vitas-M small molecule compound
N-(1,3-benzodioxol-5-yl)-N-{2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-oxoethyl}methanesulfonamide
Catalog ID
STL119426
SMILES O=C(N1CCN(CC1)c1cccc(c1C)C)CN(S(=O)(=O)C)c1ccc2c(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 C22H27N3O5S MW 445.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27N3O5S/c1-16-5-4-6-19(17(16)2)23-9-11-24(12-10-23)22(26)14-25(31(3,27)28)18-7-8-20-21(13-18)30-15-29-20/h4-8,13H,9-12,14-15H2,1-3H3InChIKey
AFKLPAYLWVMNMH-UHFFFAOYSA-NSynonyms
CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)CN(C3=CC4=C(C=C3)OCO4)S(=O)(=O)C)C
InChI=1SC22H27N3O5Sc11654619(17(16)2)2391124(121023)22(26)1425(31(327)28)18782021(1318)30152920h4813H9121415H213H3
MFCD07396105
N(13benzodioxol5yl)N(2(4(23dimethylphenyl)piperazin1yl)2oxoethyl)methanesulfonamide
ZINC000013566688
ZINC13566688
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