Vitas-M small molecule compound

methyl 4-({[(6-bromo-1H-imidazo[4,5-b]pyridin-2-yl)sulfanyl]acetyl}amino)benzoate

Catalog ID
STK647820
SMILES COC(=O)c1ccc(cc1)NC(=O)CSc1nc2c([nH]1)cc(cn2)Br

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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 C16H13BrN4O3S MW 421.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13BrN4O3S/c1-24-15(23)9-2-4-11(5-3-9)19-13(22)8-25-16-20-12-6-10(17)7-18-14(12)21-16/h2-7H,8H2,1H3,(H,19,22)(H,18,20,21)
InChIKey
CZQJAACLCQYAKM-UHFFFAOYSA-N
Synonyms
849000-81-3
849000813
COC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC3=NC=C(C=C3N2)Br
COC(=O)c1ccc(cc1)NC(=O)CSc1nc2c((nH)1)cc(cn2)Br
COC(=O)c1ccc(cc1)NC(=O)CSc1nc2c((nH)1)ncc(c2)Br
InChI=1SC16H13BrN4O3Sc12415(23)92411(539)1913(22)825162012610(17)71814(12)2116h27H8H21H3(H1922)(H182021)
methyl4((((6bromo1Himidazo(45b)pyridin2yl)sulfanyl)acetyl)amino)benzoate
METHYL4((2((6BROMO1HIMIDAZO(45B)PYRIDIN2YL)SULFANYL)ACETYL)AMINO)BENZOATE
methyl4(2((6bromo3Himidazo(45b)pyridin2yl)thio)acetamido)benzoate
MFCD18164687
ZINC000009210903
ZINC09210903
ZINC9210903

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Available files

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