Vitas-M small molecule compound
2-{[5-(1-benzofuran-2-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(3,4-dihydroquinolin-1(2H)-yl)ethanone
Catalog ID
STK246071
SMILES Cn1c(nnc1c1cc2c(o1)cccc2)SCC(=O)N1CCCc2c1cccc2
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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 C22H20N4O2S MW 404.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N4O2S/c1-25-21(19-13-16-8-3-5-11-18(16)28-19)23-24-22(25)29-14-20(27)26-12-6-9-15-7-2-4-10-17(15)26/h2-5,7-8,10-11,13H,6,9,12,14H2,1H3InChIKey
KDZIZSHRTDSORO-UHFFFAOYSA-NSynonyms
2((5(1BENZOFURAN2YL)4METHYL124TRIAZOL3YL)SULFANYL)1(34DIHYDRO2HQUINOLIN1YL)ETHANONE
2((5(1BENZOFURAN2YL)4METHYL4H124TRIAZOL3YL)SULFANYL)1(34DIHYDROQUINOLIN1(2H)YL)ETHANONE
2(5BENZOFURAN2YL4METHYL4H(124)TRIAZOL3YLSULFANYL)1(34DIHYDRO2HQUINOLIN1YL)ETHANONE
CN1C(=NN=C1SCC(=O)N2CCCC3=CC=CC=C32)C4=CC5=CC=CC=C5O4
InChI=1SC22H20N4O2Sc12521(1913168351118(16)2819)232422(25)291420(27)261269157241017(15)26h2578101113H691214H21H3
MFCD08670976
ZINC000007341906
ZINC07341906
ZINC7341906
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