Vitas-M small molecule compound

(5Z)-3-(1,3-benzodioxol-5-ylmethyl)-5-{[3-(3-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-2-thioxo-1,3-thiazolidin-4-one

Catalog ID
STK704085
SMILES S=C1S/C(=C\c2cn(nc2c2cccc(c2)[N+](=O)[O-])c2ccccc2)/C(=O)N1Cc1ccc2c(c1)OCO2

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 C27H18N4O5S2 MW 542.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H18N4O5S2/c32-26-24(38-27(37)29(26)14-17-9-10-22-23(11-17)36-16-35-22)13-19-15-30(20-6-2-1-3-7-20)28-25(19)18-5-4-8-21(12-18)31(33)34/h1-13,15H,14,16H2/b24-13-
InChIKey
ZCFOPTZKDAJHOS-CFRMEGHHSA-N
Synonyms
955875-74-8
(5Z)3(13benzodioxol5ylmethyl)5((3(3nitrophenyl)1phenyl1Hpyrazol4yl)methylidene)2thioxo13thiazolidin4one
(5Z)3(13BENZODIOXOL5YLMETHYL)5((3(3NITROPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)3(benzo(d)(13)dioxol5ylmethyl)5((3(3nitrophenyl)1phenyl1Hpyrazol4yl)methylene)2thioxothiazolidin4one
955875748
C1OC2=C(O1)C=C(C=C2)CN3C(=O)C(=CC4=CN(N=C4C5=CC(=CC=C5)(N+)(=O)(O))C6=CC=CC=C6)SC3=S
InChI=1SC27H18N4O5S2c322624(3827(37)29(26)14179102223(1117)36163522)13191530(206213720)2825(19)1854821(1218)31(33)34h11315H1416H2b2413
MFCD03213154
S=C1SC(=Cc2cn(nc2c2cccc(c2)(N+)(=O)(O))c2ccccc2)C(=O)N1Cc1ccc2c(c1)OCO2
ZINC000100897055
ZINC100897055

Check stock

See real-time availability and sample size for STK704085 on the Vitas-M platform.

Check stock on Vitas-M

Available files

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