Vitas-M small molecule compound
2-[2-(1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)ethyl]-4,5-dimethoxy-N-(pyridin-3-ylmethyl)benzenesulfonamide
Catalog ID
STK543732
SMILES COc1cc(c(cc1OC)CCn1c(=O)c2cccc3c2c(c1=O)ccc3)S(=O)(=O)NCc1cccnc1
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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 C28H25N3O6S MW 531.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25N3O6S/c1-36-23-14-20(25(15-24(23)37-2)38(34,35)30-17-18-6-5-12-29-16-18)11-13-31-27(32)21-9-3-7-19-8-4-10-22(26(19)21)28(31)33/h3-10,12,14-16,30H,11,13,17H2,1-2H3InChIKey
RZRNVYVOQXSYMW-UHFFFAOYSA-NSynonyms
452089-58-62(2(13dioxo1Hbenzo(de)isoquinolin2(3H)yl)ethyl)45dimethoxyN(pyridin3ylmethyl)benzenesulfonamide
2(2(13dioxo1Hbenzo(de)isoquinolin2(3H)yl)ethyl)45dimethoxyN(pyridin3ylmethyl)benzenesulfonamidehydrate
2(2(13DIOXOBENZO(DE)ISOQUINOLIN2YL)ETHYL)45DIMETHOXYN(PYRIDIN3YLMETHYL)BENZENESULFONAMIDE
452089586
COC1=C(C=C(C(=C1)CCN2C(=O)C3=CC=CC4=C3C(=CC=C4)C2=O)S(=O)(=O)NCC5=CN=CC=C5)OC
COc1cc(c(cc1OC)CCn1c(=O)c2cccc3c2c(c1=O)ccc3)S(=O)(=O)NCc1cccnc1O
InChI=1SC28H25N3O6Sc136231420(25(1524(23)372)38(3435)3017186512291618)11133127(32)2193719841022(26(19)21)28(31)33h31012141630H111317H212H3
MFCD03299792
ZINC000033355582
ZINC33355582
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.