Vitas-M small molecule compound
3-({4-[(4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene)methyl]phenoxy}methyl)benzoic acid
Catalog ID
STK187116
SMILES S=C1NC(=O)C(=Cc2ccc(cc2)OCc2cccc(c2)C(=O)O)C(=O)N1
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 C19H14N2O5S MW 382.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H14N2O5S/c22-16-15(17(23)21-19(27)20-16)9-11-4-6-14(7-5-11)26-10-12-2-1-3-13(8-12)18(24)25/h1-9H,10H2,(H,24,25)(H2,20,21,22,23,27)InChIKey
IFSWCPOKWFOQQZ-UHFFFAOYSA-NSynonyms
3((4((46DIOXO2SULFANYLIDENE13DIAZINAN5YLIDENE)METHYL)PHENOXY)METHYL)BENZOICACID
3((4((46DIOXO2THIOXOTETRAHYDROPYRIMIDIN5(2H)YLIDENE)METHYL)PHENOXY)METHYL)BENZOICACID
3((4((E)(6HYDROXY4OXO2SULFANYLPYRIMIDIN5(4H)YLIDENE)METHYL)PHENOXY)METHYL)BENZOICACID
C1=CC(=CC(=C1)COC2=CC=C(C=C2)C=C3C(=O)NC(=S)NC3=O)C(=O)O
InChI=1SC19H14N2O5Sc221615(17(23)2119(27)2016)9114614(7511)26101221313(812)18(24)25h19H10H2(H2425)(H22021222327)
MFCD02219808
ZINC4723722
Check stock
See real-time availability and sample size for STK187116 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.