Vitas-M small molecule compound

N-(2-cyanophenyl)-2-[(4-methoxy-6-oxo-1,6-dihydropyrimidin-2-yl)sulfanyl]acetamide

Catalog ID
STK236267
SMILES COc1cc(=O)[nH]c(n1)SCC(=O)Nc1ccccc1C#N

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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 C14H12N4O3S MW 316.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H12N4O3S/c1-21-13-6-11(19)17-14(18-13)22-8-12(20)16-10-5-3-2-4-9(10)7-15/h2-6H,8H2,1H3,(H,16,20)(H,17,18,19)
InChIKey
UBZDCZNHCVFJIZ-UHFFFAOYSA-N
Synonyms

COC1=CC(=O)NC(=N1)SCC(=O)NC2=CC=CC=C2C#N
COc1cc(=O)(nH)c(n1)SCC(=O)Nc1ccccc1C#N
InChI=1SC14H12N4O3Sc12113611(19)1714(1813)22812(20)161053249(10)715h26H8H21H3(H1620)(H171819)
MFCD07792619
N(2cyanophenyl)2((4methoxy6oxo16dihydropyrimidin2yl)sulfanyl)acetamide
N(2CYANOPHENYL)2((4METHOXY6OXO1HPYRIMIDIN2YL)SULFANYL)ACETAMIDE
ZINC000004999547
ZINC04999547
ZINC4999547

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.