Vitas-M small molecule compound
(2E)-3-(1,3-benzodioxol-5-yl)-N-[4-(piperidin-1-ylsulfonyl)phenyl]prop-2-enamide
Catalog ID
STL112948
SMILES O=C(Nc1ccc(cc1)S(=O)(=O)N1CCCCC1)/C=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 C21H22N2O5S MW 414.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N2O5S/c24-21(11-5-16-4-10-19-20(14-16)28-15-27-19)22-17-6-8-18(9-7-17)29(25,26)23-12-2-1-3-13-23/h4-11,14H,1-3,12-13,15H2,(H,22,24)/b11-5+InChIKey
UFPBYLYRYJJGJH-VZUCSPMQSA-NSynonyms
(2E)3(13benzodioxol5yl)N(4(piperidin1ylsulfonyl)phenyl)prop2enamide
(E)3(13BENZODIOXOL5YL)N(4PIPERIDIN1YLSULFONYLPHENYL)PROP2ENAMIDE
C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C=CC3=CC4=C(C=C3)OCO4
InChI=1SC21H22N2O5Sc2421(115164101920(1416)28152719)22176818(9717)29(2526)23122131323h41114H13121315H2(H2224)b115+
MFCD03068102
O=C(Nc1ccc(cc1)S(=O)(=O)N1CCCCC1)C=Cc1ccc2c(c1)OCO2
ZINC000005895389
ZINC05895389
ZINC5895389
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