Vitas-M small molecule compound
2-({2-iodo-6-methoxy-4-[(Z)-(4-oxo-3-propyl-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]phenoxy}methyl)benzonitrile
Catalog ID
STK394216
SMILES CCCN1C(=S)S/C(=C\c2cc(I)c(c(c2)OC)OCc2ccccc2C#N)/C1=O
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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 C22H19IN2O3S2 MW 550.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19IN2O3S2/c1-3-8-25-21(26)19(30-22(25)29)11-14-9-17(23)20(18(10-14)27-2)28-13-16-7-5-4-6-15(16)12-24/h4-7,9-11H,3,8,13H2,1-2H3/b19-11-InChIKey
NXEFGNIJLFOJDV-ODLFYWEKSA-NSynonyms
2((2IODO6METHOXY4((Z)(4OXO3PROPYL2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)PHENOXY)METHYL)BENZONITRILE
2((2iodo6methoxy4((Z)(4oxo3propyl2thioxo13thiazolidin5ylidene)methyl)phenoxy)methyl)benzonitrile
CCCN1C(=O)C(=CC2=CC(=C(C(=C2)I)OCC3=CC=CC=C3C#N)OC)SC1=S
CCCN1C(=S)SC(=Cc2cc(I)c(c(c2)OC)OCc2ccccc2C#N)C1=O
InChI=1SC22H19IN2O3S2c1382521(26)19(3022(25)29)1114917(23)20(18(1014)272)281316754615(16)1224h47911H3813H212H3b1911
MFCD05134644
ZINC000097964137
ZINC97964137
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