Vitas-M small molecule compound
N-(5-benzyl-3-cyano-4-methyl-1H-pyrrol-2-yl)-2-[(4-methoxy-6-oxo-1,6-dihydropyrimidin-2-yl)sulfanyl]acetamide
Catalog ID
STK690318
SMILES N#Cc1c(NC(=O)CSc2nc(OC)cc(=O)[nH]2)[nH]c(c1C)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 C20H19N5O3S MW 409.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19N5O3S/c1-12-14(10-21)19(22-15(12)8-13-6-4-3-5-7-13)23-17(27)11-29-20-24-16(26)9-18(25-20)28-2/h3-7,9,22H,8,11H2,1-2H3,(H,23,27)(H,24,25,26)InChIKey
DGPOADGJMFLMFT-UHFFFAOYSA-NSynonyms
CC1=C(NC(=C1C#N)NC(=O)CSC2=NC(=CC(=O)N2)OC)CC3=CC=CC=C3
InChI=1SC20H19N5O3Sc11214(1021)19(2215(12)8136435713)2317(27)1129202416(26)918(2520)282h37922H811H212H3(H2327)(H242526)
MFCD09063501
N#Cc1c(NC(=O)CSc2nc(OC)cc(=O)(nH)2)(nH)c(c1C)Cc1ccccc1
N(3CYANO4METHYL5BENZYLPYRROL2YL)2(6METHOXY4OXO(3HYDROPYRIMIDIN2YLTHIO))ACETAMIDE
N(5benzyl3cyano4methyl1Hpyrrol2yl)2((4methoxy6oxo16dihydropyrimidin2yl)sulfanyl)acetamide
N(5benzyl3cyano4methyl1Hpyrrol2yl)2((4methoxy6oxo1Hpyrimidin2yl)sulfanyl)acetamide
ZINC000012372018
ZINC12372018
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