Vitas-M small molecule compound
N-{2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-oxoethyl}-N-(3,4-dimethylphenyl)methanesulfonamide
Catalog ID
STK086448
SMILES O=C(N1CCN(CC1)Cc1ccc2c(c1)OCO2)CN(S(=O)(=O)C)c1ccc(c(c1)C)C
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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 C23H29N3O5S MW 459.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H29N3O5S/c1-17-4-6-20(12-18(17)2)26(32(3,28)29)15-23(27)25-10-8-24(9-11-25)14-19-5-7-21-22(13-19)31-16-30-21/h4-7,12-13H,8-11,14-16H2,1-3H3InChIKey
IIWBKAIVFFOKNJ-UHFFFAOYSA-NSynonyms
CC1=C(C=C(C=C1)N(CC(=O)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4)S(=O)(=O)C)C
InChI=1SC23H29N3O5Sc1174620(1218(17)2)26(32(328)29)1523(27)2510824(91125)1419572122(1319)31163021h471213H8111416H213H3
MFCD03570315
N(2(4(13BENZODIOXOL5YLMETHYL)PIPERAZIN1YL)2OXOETHYL)N(34DIMETHYLPHENYL)METHANESULFONAMIDE
O=C(N1CCN(CC1)Cc1ccc2c(c1)OCO2)CN(S(=O)(=O)C)c1ccc(c(c1)C)C
STK086448
ZINC000019973439
ZINC19973439
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