Vitas-M small molecule compound
2-{[2-(3,4-dihydroquinolin-1(2H)-yl)-2-oxoethyl]sulfanyl}-6-methoxypyrimidin-4(3H)-one
Catalog ID
STK239285
SMILES COc1cc(=O)[nH]c(n1)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 C16H17N3O3S MW 331.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17N3O3S/c1-22-14-9-13(20)17-16(18-14)23-10-15(21)19-8-4-6-11-5-2-3-7-12(11)19/h2-3,5,7,9H,4,6,8,10H2,1H3,(H,17,18,20)InChIKey
UKKXMUDXPKILHV-UHFFFAOYSA-NSynonyms
2((2(34dihydroquinolin1(2H)yl)2oxoethyl)sulfanyl)6methoxypyrimidin4(3H)one
2(2(34dihydro2Hquinolin1yl)2oxoethyl)sulfanyl4methoxy1Hpyrimidin6one
COC1=CC(=O)NC(=N1)SCC(=O)N2CCCC3=CC=CC=C32
COc1cc(=O)(nH)c(n1)SCC(=O)N1CCCc2c1cccc2
InChI=1SC16H17N3O3Sc12214913(20)1716(1814)231015(21)1984611523712(11)19h23579H46810H21H3(H171820)
MFCD08685283
ZINC000009191462
ZINC09191462
ZINC9191462
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