Vitas-M small molecule compound

methyl 3-hydroxy-5-[3-(3-hydroxyphenyl)-5-sulfanyl-4H-1,2,4-triazol-4-yl]-5H-pyrazolo[4,3-c]pyridine-7-carboxylate

Catalog ID
STL567786
SMILES COC(=O)c1cn(cc2c1nnc2O)n1c(S)nnc1c1cccc(c1)O

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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 C16H12N6O4S MW 384.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12N6O4S/c1-26-15(25)11-7-21(6-10-12(11)17-19-14(10)24)22-13(18-20-16(22)27)8-3-2-4-9(23)5-8/h2-7,23H,1H3,(H,19,24)(H,20,27)
InChIKey
CNEQPRZERUHCJT-UHFFFAOYSA-N
Synonyms

127254876
InChI=1SC16H12N6O4Sc12615(25)11721(61012(11)171914(10)24)2213(182016(22)27)83249(23)58h2723H1H3(H1924)(H2027)
methyl3hydroxy5(3(3hydroxyphenyl)5sulfanyl4H124triazol4yl)5Hpyrazolo(43c)pyridine7carboxylate
methyl5(3(3hydroxyphenyl)5sulfanylidene1H124triazol4yl)3oxo2Hpyrazolo(43c)pyridine7carboxylate
MFCD32652965
ZINC000604418987

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Available files

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