Vitas-M small molecule compound

9-tert-butyl-2-{4-[(5-methyl-3-nitro-1H-pyrazol-1-yl)methyl]phenyl}-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine

Catalog ID
STK308869
SMILES [O-][N+](=O)c1nn(c(c1)C)Cc1ccc(cc1)c1nn2c(n1)c1c(nc2)sc2c1CCC(C2)C(C)(C)C

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 C26H27N7O2S MW 501.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N7O2S/c1-15-11-21(33(34)35)29-31(15)13-16-5-7-17(8-6-16)23-28-24-22-19-10-9-18(26(2,3)4)12-20(19)36-25(22)27-14-32(24)30-23/h5-8,11,14,18H,9-10,12-13H2,1-4H3
InChIKey
VPPBBDZDDPOQGB-UHFFFAOYSA-N
Synonyms
1005633-43-1
(O)(N+)(=O)c1nn(c(c1)C)Cc1ccc(cc1)c1nn2c(n1)c1c(nc2)sc2c1CCC(C2)C(C)(C)C
1005633431
9tertbutyl2(4((5methyl3nitro1Hpyrazol1yl)methyl)phenyl)891011tetrahydro(1)benzothieno(32e)(124)triazolo(15c)pyrimidine
CC1=CC(=NN1CC2=CC=C(C=C2)C3=NN4C=NC5=C(C4=N3)C6=C(S5)CC(CC6)C(C)(C)C)(N+)(=O)(O)
InChI=1SC26H27N7O2Sc1151121(33(34)35)2931(15)13165717(8616)232824221910918(26(23)4)1220(19)3625(22)271432(24)3023h58111418H9101213H214H3
MFCD04132835
ZINC000002798456
ZINC000002798457

Check stock

See real-time availability and sample size for STK308869 on the Vitas-M platform.

Check stock on Vitas-M

Available files

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