Vitas-M small molecule compound
ethyl 7-cyano-3-cyclopentyl-6-thioxo-1,3,4,6-tetrahydro-2H-pyrido[1,2-a][1,3,5]triazine-9-carboxylate
Catalog ID
STL350300
SMILES CCOC(=O)c1cc(C#N)c(=S)n2c1NCN(C2)C1CCCC1
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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 C16H20N4O2S MW 332.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H20N4O2S/c1-2-22-16(21)13-7-11(8-17)15(23)20-10-19(9-18-14(13)20)12-5-3-4-6-12/h7,12,18H,2-6,9-10H2,1H3InChIKey
WLOXNRJFICWNNF-UHFFFAOYSA-NSynonyms
919724-31-5919724315
CCOC(=O)C1=C2NCN(CN2C(=S)C(=C1)C#N)C3CCCC3
ethyl7cyano3cyclopentyl6sulfanylidene24dihydro1Hpyrido(12a)(135)triazine9carboxylate
ethyl7cyano3cyclopentyl6thioxo1346tetrahydro2Hpyrido(12a)(135)triazine9carboxylate
ethyl7cyano3cyclopentyl6thioxo2346tetrahydro1Hpyrido(12a)(135)triazine9carboxylate
InChI=1SC16H20N4O2Sc122216(21)13711(817)15(23)201019(91814(13)20)12534612h71218H26910H21H3
MFCD08750626
ZINC000009419677
ZINC9419677
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