Vitas-M small molecule compound

N-[1-(2,5-dimethoxyphenyl)ethyl]-2-{[4-(1-ethyl-3-methyl-1H-pyrazol-4-yl)pyrimidin-2-yl]sulfanyl}acetamide

Catalog ID
STL403624
SMILES COc1ccc(cc1C(NC(=O)CSc1nccc(n1)c1cn(nc1C)CC)C)OC

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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 C22H27N5O3S MW 441.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27N5O3S/c1-6-27-12-18(15(3)26-27)19-9-10-23-22(25-19)31-13-21(28)24-14(2)17-11-16(29-4)7-8-20(17)30-5/h7-12,14H,6,13H2,1-5H3,(H,24,28)
InChIKey
CQKQEYNOFDUXDS-UHFFFAOYSA-N
Synonyms
1005625-99-9
1005625999
CCN1C=C(C(=N1)C)C2=NC(=NC=C2)SCC(=O)NC(C)C3=C(C=CC(=C3)OC)OC
InChI=1SC22H27N5O3Sc16271218(15(3)2627)199102322(2519)311321(28)2414(2)171116(294)7820(17)305h71214H613H215H3(H2428)
MFCD04140129
N(1(25dimethoxyphenyl)ethyl)2((4(1ethyl3methyl1Hpyrazol4yl)pyrimidin2yl)sulfanyl)acetamide
N(1(25dimethoxyphenyl)ethyl)2(4(1ethyl3methylpyrazol4yl)pyrimidin2yl)sulfanylacetamide
ZINC000002730917
ZINC000002730918

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Available files

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