Vitas-M small molecule compound
5-benzyl-6-methyl-2-{[2-(2-methylphenoxy)ethyl]sulfanyl}pyrimidin-4(3H)-one
Catalog ID
STK710726
SMILES Cc1ccccc1OCCSc1nc(C)c(c(=O)[nH]1)Cc1ccccc1
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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 C21H22N2O2S MW 366.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N2O2S/c1-15-8-6-7-11-19(15)25-12-13-26-21-22-16(2)18(20(24)23-21)14-17-9-4-3-5-10-17/h3-11H,12-14H2,1-2H3,(H,22,23,24)InChIKey
NQIJAPFDUPUNTQ-UHFFFAOYSA-NSynonyms
5BENZYL6METHYL2((2(2METHYLPHENOXY)ETHYL)SULFANYL)PYRIMIDIN4(3H)ONE
5BENZYL6METHYL2(2(2METHYLPHENOXY)ETHYLSULFANYL)1HPYRIMIDIN4ONE
CC1=CC=CC=C1OCCSC2=NC(=O)C(=C(N2)C)CC3=CC=CC=C3
Cc1ccccc1OCCSc1nc(C)c(c(=O)(nH)1)Cc1ccccc1
InChI=1SC21H22N2O2Sc1158671119(15)25121326212216(2)18(20(24)2321)141794351017h311H1214H212H3(H222324)
MFCD05838165
ZINC000004626374
ZINC4626374
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