Vitas-M small molecule compound
ethyl 7-cyano-3-(2-fluorophenyl)-6-thioxo-1,3,4,6-tetrahydro-2H-pyrido[1,2-a][1,3,5]triazine-9-carboxylate
Catalog ID
STL350320
SMILES CCOC(=O)c1cc(C#N)c(=S)n2c1NCN(C2)c1ccccc1F
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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 C17H15FN4O2S MW 358.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15FN4O2S/c1-2-24-17(23)12-7-11(8-19)16(25)22-10-21(9-20-15(12)22)14-6-4-3-5-13(14)18/h3-7,20H,2,9-10H2,1H3InChIKey
VDLNTWMXKJUAPI-UHFFFAOYSA-NSynonyms
919748-02-0919748020
CCOC(=O)C1=C2NCN(CN2C(=S)C(=C1)C#N)C3=CC=CC=C3F
ethyl7cyano3(2fluorophenyl)6sulfanylidene24dihydro1Hpyrido(12a)(135)triazine9carboxylate
ethyl7cyano3(2fluorophenyl)6thioxo1346tetrahydro2Hpyrido(12a)(135)triazine9carboxylate
ethyl7cyano3(2fluorophenyl)6thioxo2346tetrahydro1Hpyrido(12a)(135)triazine9carboxylate
InChI=1SC17H15FN4O2Sc122417(23)12711(819)16(25)221021(92015(12)22)14643513(14)18h3720H2910H21H3
MFCD08751156
ZINC000009420323
ZINC09420323
ZINC9420323
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