Vitas-M small molecule compound
2-[(4-{(E)-[2,4-dioxo-3-(prop-2-yn-1-yl)-1,3-thiazolidin-5-ylidene]methyl}-2-iodo-6-methoxyphenoxy)methyl]benzonitrile
Catalog ID
STK152701
SMILES C#CCN1C(=O)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 C22H15IN2O4S MW 530.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H15IN2O4S/c1-3-8-25-21(26)19(30-22(25)27)11-14-9-17(23)20(18(10-14)28-2)29-13-16-7-5-4-6-15(16)12-24/h1,4-7,9-11H,8,13H2,2H3/b19-11+InChIKey
FFJNGLWXMSLLLS-YBFXNURJSA-NSynonyms
2((4((24DIOXO3PROP2YNYL(13THIAZOLIDIN5YLIDENE))METHYL)2IODO6METHOXYPHENOXY)METHYL)BENZENECARBONITRILE
2((4((E)(24DIOXO3(PROP2YN1YL)13THIAZOLIDIN5YLIDENE)METHYL)2IODO6METHOXYPHENOXY)METHYL)BENZONITRILE
2((4((E)(24dioxo3prop2ynyl13thiazolidin5ylidene)methyl)2iodo6methoxyphenoxy)methyl)benzonitrile
C#CCN1C(=O)SC(=Cc2cc(I)c(c(c2)OC)OCc2ccccc2C#N)C1=O
COC1=C(C(=CC(=C1)C=C2C(=O)N(C(=O)S2)CC#C)I)OCC3=CC=CC=C3C#N
InChI=1SC22H15IN2O4Sc1382521(26)19(3022(25)27)1114917(23)20(18(1014)282)291316754615(16)1224h147911H813H22H3b1911+
MFCD03649495
ZINC000097959823
ZINC97959823
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