Vitas-M small molecule compound
ethyl 2-{[(1-benzyl-3-nitro-1H-pyrazol-5-yl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK765044
SMILES CCOC(=O)c1c(NC(=O)c2cc(nn2Cc2ccccc2)[N+](=O)[O-])sc2c1CCCC2
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 C22H22N4O5S MW 454.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N4O5S/c1-2-31-22(28)19-15-10-6-7-11-17(15)32-21(19)23-20(27)16-12-18(26(29)30)24-25(16)13-14-8-4-3-5-9-14/h3-5,8-9,12H,2,6-7,10-11,13H2,1H3,(H,23,27)InChIKey
HMFHWDPPZYRGLM-UHFFFAOYSA-NSynonyms
403714-88-5403714885
CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)C3=CC(=NN3CC4=CC=CC=C4)(N+)(=O)(O)
CCOC(=O)c1c(NC(=O)c2cc(nn2Cc2ccccc2)(N+)(=O)(O))sc2c1CCCC2
ethyl2(((1benzyl3nitro1Hpyrazol5yl)carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl2((2benzyl5nitropyrazole3carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
InChI=1SC22H22N4O5Sc123122(28)191510671117(15)3221(19)2320(27)161218(26(29)30)2425(16)13148435914h358912H267101113H21H3(H2327)
MFCD02242903
ZINC000000671971
ZINC00671971
ZINC671971
Check stock
See real-time availability and sample size for STK765044 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.