Vitas-M small molecule compound
(2Z)-2-[5-(3,4-dimethylbenzyl)-4-oxo-1,3-thiazolidin-2-ylidene]-3-oxobutanenitrile
Catalog ID
STK740646
SMILES N#C/C(=C/1\NC(=O)C(S1)Cc1ccc(c(c1)C)C)/C(=O)C
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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 C16H16N2O2S MW 300.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N2O2S/c1-9-4-5-12(6-10(9)2)7-14-15(20)18-16(21-14)13(8-17)11(3)19/h4-6,14H,7H2,1-3H3,(H,18,20)/b16-13-InChIKey
WTLJJAYZTMBARP-SSZFMOIBSA-NSynonyms
799780-50-0(2Z)2(5((34DIMETHYLPHENYL)METHYL)4OXO13THIAZOLIDIN2YLIDENE)3OXOBUTANENITRILE
(2Z)2(5(34dimethylbenzyl)4oxo13thiazolidin2ylidene)3oxobutanenitrile
(E)2(5(34dimethylbenzyl)4oxothiazolidin2ylidene)3oxobutanenitrile
2(5((34DIMETHYLPHENYL)METHYL)4OXO(13THIAZOLIDIN2YLIDENE))3OXOBUTANENITRILE
799780500
CC1=C(C=C(C=C1)CC2C(=O)NC(=C(C#N)C(=O)C)S2)C
InChI=1SC16H16N2O2Sc194512(610(9)2)71415(20)1816(2114)13(817)11(3)19h4614H7H213H3(H1820)b1613
MFCD06438434
N#CC(=C1NC(=O)C(S1)Cc1ccc(c(c1)C)C)C(=O)C
ZINC000013110739
ZINC000013110740
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