Vitas-M small molecule compound

methyl (2E)-5-phenyl-2-{[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)butanoyl]imino}-2,3-dihydro-1,3-thiazole-4-carboxylate

Catalog ID
STL410619
SMILES COC(=O)c1[nH]/c(=N\C(=O)CCCc2nnc3n2cccc3)/sc1c1ccccc1

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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 C21H19N5O3S MW 421.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N5O3S/c1-29-20(28)18-19(14-8-3-2-4-9-14)30-21(23-18)22-17(27)12-7-11-16-25-24-15-10-5-6-13-26(15)16/h2-6,8-10,13H,7,11-12H2,1H3,(H,22,23,27)
InChIKey
QUMJRMHUKCQDSD-UHFFFAOYSA-N
Synonyms
1574317-64-8
1574317648
COC(=O)c1(nH)c(=NC(=O)CCCc2nnc3n2cccc3)sc1c1ccccc1
COC(=O)C1=C(SC(=N1)NC(=O)CCCC2=NN=C3N2C=CC=C3)C4=CC=CC=C4
InChI=1SC21H19N5O3Sc12920(28)1819(148324914)3021(2318)2217(27)127111625241510561326(15)16h2681013H71112H21H3(H222327)
methyl(2E)5phenyl2((4((124)triazolo(43a)pyridin3yl)butanoyl)imino)23dihydro13thiazole4carboxylate
methyl5phenyl2(4((124)triazolo(43a)pyridin3yl)butanoylamino)13thiazole4carboxylate
MFCD30706299
ZINC000096118440
ZINC96118440

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Available files

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