Vitas-M small molecule compound

(2Z)-2-[5-(3-chloro-4-methylbenzyl)-4-oxo-1,3-thiazolidin-2-ylidene]-3-oxobutanenitrile

Catalog ID
STK740643
SMILES N#C/C(=C/1\NC(=O)C(S1)Cc1ccc(c(c1)Cl)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 C15H13ClN2O2S MW 320.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H13ClN2O2S/c1-8-3-4-10(5-12(8)16)6-13-14(20)18-15(21-13)11(7-17)9(2)19/h3-5,13H,6H2,1-2H3,(H,18,20)/b15-11-
InChIKey
STOJBCRSBMZIEX-PTNGSMBKSA-N
Synonyms

(2Z)2(5((3CHLORO4METHYLPHENYL)METHYL)4OXO13THIAZOLIDIN2YLIDENE)3OXOBUTANENITRILE
(2Z)2(5(3chloro4methylbenzyl)4oxo13thiazolidin2ylidene)3oxobutanenitrile
(E)2(5(3chloro4methylbenzyl)4oxothiazolidin2ylidene)3oxobutanenitrile
2(5((3CHLORO4METHYLPHENYL)METHYL)4OXO(13THIAZOLIDIN2YLIDENE))3OXOBUTANENITRILE
CC1=C(C=C(C=C1)CC2C(=O)NC(=C(C#N)C(=O)C)S2)Cl
InChI=1SC15H13ClN2O2Sc183410(512(8)16)61314(20)1815(2113)11(717)9(2)19h3513H6H212H3(H1820)b1511
MFCD06438431
N#CC(=C1NC(=O)C(S1)Cc1ccc(c(c1)Cl)C)C(=O)C
ZINC000013635874
ZINC000013635876

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Available files

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