Vitas-M small molecule compound

1-[3-(prop-2-en-1-ylsulfanyl)-6-(pyridin-2-yl)[1,2,4]triazino[5,6-d][3,1]benzoxazepin-7(6H)-yl]propan-1-one

Catalog ID
STK980173
SMILES C=CCSc1nnc2c(n1)OC(c1ccccn1)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 C21H19N5O2S MW 405.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N5O2S/c1-3-13-29-21-23-19-18(24-25-21)14-9-5-6-11-16(14)26(17(27)4-2)20(28-19)15-10-7-8-12-22-15/h3,5-12,20H,1,4,13H2,2H3
InChIKey
ZSPNRRADTKYJMX-UHFFFAOYSA-N
Synonyms

1(3(prop2en1ylsulfanyl)6(pyridin2yl)(124)triazino(56d)(31)benzoxazepin7(6H)yl)propan1one
1(3PROP2ENYLSULFANYL6PYRIDIN2YL6H(124)TRIAZINO(56D)(31)BENZOXAZEPIN7YL)PROPAN1ONE
CCC(=O)N1C(OC2=C(C3=CC=CC=C31)N=NC(=N2)SCC=C)C4=CC=CC=N4
InChI=1SC21H19N5O2Sc13132921231918(242521)149561116(14)26(17(27)42)20(2819)151078122215h351220H1413H22H3
MFCD03784965
ZINC000002463704
ZINC000002463707

Check stock

See real-time availability and sample size for STK980173 on the Vitas-M platform.

Check stock on Vitas-M

Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.