Vitas-M small molecule compound
2-({4-amino-5-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-1-(morpholin-4-yl)ethanone
Catalog ID
STK590823
SMILES COc1ccc(cc1)c1[nH]nc(c1)c1nnc(n1N)SCC(=O)N1CCOCC1
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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 C18H21N7O3S MW 415.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21N7O3S/c1-27-13-4-2-12(3-5-13)14-10-15(21-20-14)17-22-23-18(25(17)19)29-11-16(26)24-6-8-28-9-7-24/h2-5,10H,6-9,11,19H2,1H3,(H,20,21)InChIKey
NDYABPDYJDLFRA-UHFFFAOYSA-NSynonyms
879441-39-12((4AMINO5(3(4METHOXYPHENYL)1HPYRAZOL5YL)124TRIAZOL3YL)SULFANYL)1MORPHOLIN4YLETHANONE
2((4amino5(3(4methoxyphenyl)1Hpyrazol5yl)4H124triazol3yl)thio)1morpholinoethanone
2((4amino5(5(4methoxyphenyl)1Hpyrazol3yl)4H124triazol3yl)sulfanyl)1(morpholin4yl)ethanone
2(4AMINO5(3(4METHOXYPHENYL)PYRAZOL5YL)(124TRIAZOL3YLTHIO))1MORPHOLIN4YLETHAN1ONE
879441391
COC1=CC=C(C=C1)C2=NNC(=C2)C3=NN=C(N3N)SCC(=O)N4CCOCC4
COc1ccc(cc1)c1(nH)nc(c1)c1nnc(n1N)SCC(=O)N1CCOCC1
COc1ccc(cc1)c1cc((nH)n1)c1nnc(n1N)SCC(=O)N1CCOCC1
InChI=1SC18H21N7O3Sc127134212(3513)141015(212014)17222318(25(17)19)291116(26)2468289724h2510H691119H21H3(H2021)
MFCD07201415
ZINC000009453749
ZINC09453749
ZINC9453749
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.