Vitas-M small molecule compound
ethyl 4-{[(4,4-dimethyl-3,8-dioxo-1-sulfanyl-3,4,7,8-tetrahydro-6H-pyrazolo[1,2-a][1,2,4]triazin-6-yl)carbonyl]amino}benzoate
Catalog ID
STK235362
SMILES CCOC(=O)c1ccc(cc1)NC(=O)C1CC(=O)N2N1C(C)(C)C(=O)N=C2S
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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 C18H20N4O5S MW 404.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N4O5S/c1-4-27-15(25)10-5-7-11(8-6-10)19-14(24)12-9-13(23)21-17(28)20-16(26)18(2,3)22(12)21/h5-8,12H,4,9H2,1-3H3,(H,19,24)(H,20,26,28)InChIKey
HJFCPRJUOMSMJI-UHFFFAOYSA-NSynonyms
956792-52-2956792522
ethyl4(((44dimethyl38dioxo1sulfanyl3478tetrahydro6Hpyrazolo(12a)(124)triazin6yl)carbonyl)amino)benzoate
ethyl4(1mercapto44dimethyl38dioxo4678tetrahydro3Hpyrazolo(12a)(124)triazine6carboxamido)benzoate
MFCD07403286
ZINC000004992826
ZINC000004992827
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