Vitas-M small molecule compound

(5Z)-3-ethyl-5-{(2E)-2-[3-(2-hydroxyethyl)-1,3-benzothiazol-2(3H)-ylidene]ethylidene}-2-thioxo-1,3-thiazolidin-4-one

Catalog ID
STK008736
SMILES OCCn1/c(=C\C=C\2/SC(=S)N(C2=O)CC)/sc2c1cccc2

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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 C16H16N2O2S3 MW 364.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N2O2S3/c1-2-17-15(20)13(23-16(17)21)7-8-14-18(9-10-19)11-5-3-4-6-12(11)22-14/h3-8,19H,2,9-10H2,1H3/b13-7-,14-8+
InChIKey
UIHORNPAHDFGLP-MFUUIURDSA-N
Synonyms

(5Z)3ETHYL5((2E)2(3(2HYDROXYETHYL)13BENZOTHIAZOL2(3H)YLIDENE)ETHYLIDENE)2THIOXO13THIAZOLIDIN4ONE
(5Z)3ETHYL5((2E)2(3(2HYDROXYETHYL)13BENZOTHIAZOL2YLIDENE)ETHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(5Z)3ETHYL5((2E)2(3(2HYDROXYETHYL)13BENZOTHIAZOL2YLIDENE)ETHYLIDENE)2SULFANYLIDENE4THIAZOLIDINONE
(5Z)3ETHYL5((2E)2(3(2HYDROXYETHYL)13BENZOTHIAZOL2YLIDENE)ETHYLIDENE)2THIOXOTHIAZOLIDIN4ONE
3ETHYL5(2(3(2HYDROXYETHYL)(3HYDROBENZOTHIAZOL2YLIDENE))ETHYLIDENE)2THIOXO13THIAZOLIDIN4ONE
CCN1C(=O)C(=CC=C2N(C3=CC=CC=C3S2)CCO)SC1=S
InChI=1SC16H16N2O2S3c121715(20)13(2316(17)21)781418(91019)11534612(11)2214h3819H2910H21H3b137148+
MFCD00392207
OCCn1c(=CC=C2SC(=S)N(C2=O)CC)sc2c1cccc2
STK008736
ZINC000001513186
ZINC01513186
ZINC1513186

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.