Vitas-M small molecule compound
3-(azepan-1-ylsulfonyl)-N-(1,3-benzodioxol-5-ylmethyl)-4-methylbenzamide
Catalog ID
STK825927
SMILES O=C(c1ccc(c(c1)S(=O)(=O)N1CCCCCC1)C)NCc1ccc2c(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 C22H26N2O5S MW 430.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N2O5S/c1-16-6-8-18(13-21(16)30(26,27)24-10-4-2-3-5-11-24)22(25)23-14-17-7-9-19-20(12-17)29-15-28-19/h6-9,12-13H,2-5,10-11,14-15H2,1H3,(H,23,25)InChIKey
DGTUZLXTSVWESS-UHFFFAOYSA-NSynonyms
690247-73-5(3(AZAPERHYDROEPINYLSULFONYL)4METHYLPHENYL)N(2HBENZO(34D)13DIOXOLAN5YLMETHYL)CARBOXAMIDE
3(azepan1ylsulfonyl)N(13benzodioxol5ylmethyl)4methylbenzamide
3(AZEPAN1YLSULFONYL)N(BENZO(D)(13)DIOXOL5YLMETHYL)4METHYLBENZAMIDE
690247735
CC1=C(C=C(C=C1)C(=O)NCC2=CC3=C(C=C2)OCO3)S(=O)(=O)N4CCCCCC4
InChI=1SC22H26N2O5Sc1166818(1321(16)30(2627)241042351124)22(25)231417791920(1217)29152819h691213H2510111415H21H3(H2325)
MFCD04445605
ZINC000002700605
ZINC02700605
ZINC2700605
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