Vitas-M small molecule compound
2-[(3-{(E)-[2,4-dioxo-3-(prop-2-yn-1-yl)-1,3-thiazolidin-5-ylidene]methyl}-1H-indol-1-yl)methyl]benzonitrile
Catalog ID
STK049064
SMILES C#CCN1C(=O)S/C(=C/c2cn(c3c2cccc3)Cc2ccccc2C#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 C23H15N3O2S MW 397.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H15N3O2S/c1-2-11-26-22(27)21(29-23(26)28)12-18-15-25(20-10-6-5-9-19(18)20)14-17-8-4-3-7-16(17)13-24/h1,3-10,12,15H,11,14H2/b21-12+InChIKey
PFJXGGHDVWNGML-CIAFOILYSA-NSynonyms
2((3((E)(24DIOXO3(PROP2YN1YL)13THIAZOLIDIN5YLIDENE)METHYL)1HINDOL1YL)METHYL)BENZONITRILE
2((3((E)(24DIOXO3PROP2YNYL13THIAZOLIDIN5YLIDENE)METHYL)INDOL1YL)METHYL)BENZONITRILE
C#CCN1C(=O)C(=CC2=CN(C3=CC=CC=C32)CC4=CC=CC=C4C#N)SC1=O
C#CCN1C(=O)SC(=Cc2cn(c3c2cccc3)Cc2ccccc2C#N)C1=O
InChI=1SC23H15N3O2Sc12112622(27)21(2923(26)28)12181525(201065919(18)20)1417843716(17)1324h13101215H1114H2b2112+
MFCD03728222
STK049064
ZINC000095481013
ZINC23441592
ZINC95481013
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