Vitas-M small molecule compound
2-fluoro-N-{1-[5-({2-[(4-methoxybenzyl)amino]-2-oxoethyl}sulfanyl)-4-methyl-4H-1,2,4-triazol-3-yl]ethyl}benzamide
Catalog ID
STK497710
SMILES COc1ccc(cc1)CNC(=O)CSc1nnc(n1C)C(NC(=O)c1ccccc1F)C
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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 C22H24FN5O3S MW 457.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24FN5O3S/c1-14(25-21(30)17-6-4-5-7-18(17)23)20-26-27-22(28(20)2)32-13-19(29)24-12-15-8-10-16(31-3)11-9-15/h4-11,14H,12-13H2,1-3H3,(H,24,29)(H,25,30)InChIKey
LEKRHLBMRZORER-UHFFFAOYSA-NSynonyms
2fluoroN(1(5((2((4methoxybenzyl)amino)2oxoethyl)sulfanyl)4methyl4H124triazol3yl)ethyl)benzamide
2fluoroN(1(5(2((4methoxyphenyl)methylamino)2oxoethyl)sulfanyl4methyl124triazol3yl)ethyl)benzamide
CC(C1=NN=C(N1C)SCC(=O)NCC2=CC=C(C=C2)OC)NC(=O)C3=CC=CC=C3F
InChI=1SC22H24FN5O3Sc114(2521(30)17645718(17)23)20262722(28(20)2)321319(29)24121581016(313)11915h41114H1213H213H3(H2429)(H2530)
MFCD11855067
ZINC000009505038
ZINC000009505041
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