Vitas-M small molecule compound
2-{2-(1,3-benzothiazol-2-yl)-4-methyl-5-[2-(morpholin-4-yl)ethyl]-3,6-dioxo-2,3,5,6-tetrahydro-1H-pyrazolo[4,3-c]pyridin-1-yl}-N-(4-chlorophenyl)acetamide
Catalog ID
STK262471
SMILES Clc1ccc(cc1)NC(=O)Cn1c2cc(=O)n(c(c2c(=O)n1c1nc2c(s1)cccc2)C)CCN1CCOCC1
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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 C28H27ClN6O4S MW 579.08 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H27ClN6O4S/c1-18-26-22(16-25(37)33(18)11-10-32-12-14-39-15-13-32)34(17-24(36)30-20-8-6-19(29)7-9-20)35(27(26)38)28-31-21-4-2-3-5-23(21)40-28/h2-9,16H,10-15,17H2,1H3,(H,30,36)InChIKey
ALMAVVKZMYJYCW-UHFFFAOYSA-NSynonyms
2(2(13benzothiazol2yl)4methyl5(2(morpholin4yl)ethyl)36dioxo2356tetrahydro1Hpyrazolo(43c)pyridin1yl)N(4chlorophenyl)acetamide
2(2(13BENZOTHIAZOL2YL)4METHYL5(2MORPHOLIN4YLETHYL)36DIOXOPYRAZOLO(43C)PYRIDIN1YL)N(4CHLOROPHENYL)ACETAMIDE
2(2BENZOTHIAZOL2YL4METHYL5(2MORPHOLIN4YLETHYL)36DIOXO(5HYDRO3PYRAZOLINO(43C)PYRIDINYL))N(4CHLOROPHENYL)ACETAMIDE
CC1=C2C(=CC(=O)N1CCN3CCOCC3)N(N(C2=O)C4=NC5=CC=CC=C5S4)CC(=O)NC6=CC=C(C=C6)Cl
InChI=1SC28H27ClN6O4Sc1182622(1625(37)33(18)111032121439151332)34(1724(36)30208619(29)7920)35(27(26)38)283121423523(21)4028h2916H101517H21H3(H3036)
MFCD07620962
ZINC000097948530
ZINC97948530
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.