Vitas-M small molecule compound

methyl 4-{[(3H-imidazo[4,5-b]pyridin-2-ylsulfanyl)acetyl]amino}benzoate

Catalog ID
STL349253
SMILES COC(=O)c1ccc(cc1)NC(=O)CSc1nc2c([nH]1)nccc2

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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 C16H14N4O3S MW 342.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14N4O3S/c1-23-15(22)10-4-6-11(7-5-10)18-13(21)9-24-16-19-12-3-2-8-17-14(12)20-16/h2-8H,9H2,1H3,(H,18,21)(H,17,19,20)
InChIKey
WREGRZRXJLSVJV-UHFFFAOYSA-N
Synonyms
877792-56-8
4((2(1HIMIDAZO(45B)PYRIDIN2YLTHIO)1OXOETHYL)AMINO)BENZOICACIDMETHYLESTER
4((2(1HIMIDAZO(45B)PYRIDIN2YLTHIO)ACETYL)AMINO)BENZOICACIDMETHYLESTER
4(2(3HIMIDAZO(45B)PYRIDIN2YLSULFANYL)ACETYLAMINO)BENZOICACIDMETHYLESTER
877792568
COC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC3=C(N2)C=CC=N3
COC(=O)c1ccc(cc1)NC(=O)CSc1nc2c((nH)1)nccc2
InChI=1SC16H14N4O3Sc12315(22)104611(7510)1813(21)9241619123281714(12)2016h28H9H21H3(H1821)(H171920)
METHYL4(((1HIMIDAZO(45B)PYRIDIN2YLSULFANYL)ACETYL)AMINO)BENZOATE
methyl4(((3Himidazo(45b)pyridin2ylsulfanyl)acetyl)amino)benzoate
METHYL4((2(1HIMIDAZO(45B)PYRIDIN2YLSULFANYL)ACETYL)AMINO)BENZOATE
methyl4(2((3Himidazo(45b)pyridin2yl)thio)acetamido)benzoate
METHYL4(2(1HIMIDAZO(45B)PYRIDIN2YLSULFANYL)ETHANOYLAMINO)BENZOATE
MFCD05702441
ZINC000018159094
ZINC18159094

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Available files

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