Vitas-M small molecule compound

(4-{(Z)-[1-(4-bromophenyl)-4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene]methyl}-2-ethoxyphenoxy)acetonitrile

Catalog ID
STK192717
SMILES N#CCOc1ccc(cc1OCC)/C=C\1/C(=O)NC(=S)N(C1=O)c1ccc(cc1)Br

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 C21H16BrN3O4S MW 486.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16BrN3O4S/c1-2-28-18-12-13(3-8-17(18)29-10-9-23)11-16-19(26)24-21(30)25(20(16)27)15-6-4-14(22)5-7-15/h3-8,11-12H,2,10H2,1H3,(H,24,26,30)/b16-11-
InChIKey
YCRVBCTWVVFWJQ-WJDWOHSUSA-N
Synonyms

(4((Z)(1(4BROMOPHENYL)46DIOXO2THIOXOTETRAHYDROPYRIMIDIN5(2H)YLIDENE)METHYL)2ETHOXYPHENOXY)ACETONITRILE
2(4((Z)(1(4bromophenyl)46dioxo2sulfanylidene13diazinan5ylidene)methyl)2ethoxyphenoxy)acetonitrile
CCOC1=C(C=CC(=C1)C=C2C(=O)NC(=S)N(C2=O)C3=CC=C(C=C3)Br)OCC#N
InChI=1SC21H16BrN3O4Sc1228181213(3817(18)2910923)111619(26)2421(30)25(20(16)27)156414(22)5715h381112H210H21H3(H242630)b1611
MFCD05039356
N#CCOc1ccc(cc1OCC)C=C1C(=O)NC(=S)N(C1=O)c1ccc(cc1)Br
ZINC000009933366
ZINC09933366
ZINC9933366

Check stock

See real-time availability and sample size for STK192717 on the Vitas-M platform.

Check stock on Vitas-M

Available files

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