Vitas-M small molecule compound
N-(5-benzyl-3-cyano-4-methyl-1H-pyrrol-2-yl)-2-[(6-methyl-5-oxo-4,5-dihydro-1,2,4-triazin-3-yl)sulfanyl]acetamide
Catalog ID
STK510672
SMILES N#Cc1c(NC(=O)CSc2nnc(c(=O)[nH]2)C)[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 C19H18N6O2S MW 394.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18N6O2S/c1-11-14(9-20)17(21-15(11)8-13-6-4-3-5-7-13)22-16(26)10-28-19-23-18(27)12(2)24-25-19/h3-7,21H,8,10H2,1-2H3,(H,22,26)(H,23,25,27)InChIKey
YBJWVUYWIPJWKH-UHFFFAOYSA-NSynonyms
CC1=C(NC(=C1C#N)NC(=O)CSC2=NC(=O)C(=NN2)C)CC3=CC=CC=C3
InChI=1SC19H18N6O2Sc11114(920)17(2115(11)8136435713)2216(26)1028192318(27)12(2)242519h3721H810H212H3(H2226)(H232527)
MFCD13370161
N#Cc1c(NC(=O)CSc2nnc(c(=O)(nH)2)C)(nH)c(c1C)Cc1ccccc1
N(5benzyl3cyano4methyl1Hpyrrol2yl)2((6methyl5oxo2H124triazin3yl)sulfanyl)acetamide
N(5benzyl3cyano4methyl1Hpyrrol2yl)2((6methyl5oxo45dihydro124triazin3yl)sulfanyl)acetamide
ZINC000036235011
ZINC36235011
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