Vitas-M small molecule compound
1-[6-(5-methylthiophen-2-yl)-3-(prop-2-en-1-ylsulfanyl)[1,2,4]triazino[5,6-d][3,1]benzoxazepin-7(6H)-yl]propan-1-one
Catalog ID
STK980258
SMILES C=CCSc1nnc2c(n1)OC(c1ccc(s1)C)N(c1c2cccc1)C(=O)CC
Contact us by email for worldwide delivery information, pricing, and real‑time availability. Send us your quotation request, and we will confirm stock levels, provide exact costs and lead times, suggest alternatives or find analogs when helpful, and share any additional specifications you may need.
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 C21H20N4O2S2 MW 424.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N4O2S2/c1-4-12-28-21-22-19-18(23-24-21)14-8-6-7-9-15(14)25(17(26)5-2)20(27-19)16-11-10-13(3)29-16/h4,6-11,20H,1,5,12H2,2-3H3InChIKey
WOBUHFKOMOJJBN-UHFFFAOYSA-NSynonyms
1(6(5methylthiophen2yl)3(prop2en1ylsulfanyl)(124)triazino(56d)(31)benzoxazepin7(6H)yl)propan1one
1(6(5METHYLTHIOPHEN2YL)3PROP2ENYLSULFANYL6H(124)TRIAZINO(56D)(31)BENZOXAZEPIN7YL)PROPAN1ONE
ALLYL6(5METHYL2THIENYL)7PROPIONYL67DIHYDRO(124)TRIAZINO(56D)(31)BENZOXAZEPIN3YLSULFIDE
CCC(=O)N1C(OC2=C(C3=CC=CC=C31)N=NC(=N2)SCC=C)C4=CC=C(S4)C
InChI=1SC21H20N4O2S2c14122821221918(232421)14867915(14)25(17(26)52)20(2719)16111013(3)2916h461120H1512H223H3
MFCD03784999
ZINC000002122465
ZINC000002122467
Check stock
See real-time availability and sample size for STK980258 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.