Vitas-M small molecule compound

N-(2,1,3-benzoxadiazol-4-yl)-4-[(5Z)-5-(2-fluorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanamide

Catalog ID
STK609646
SMILES O=C(Nc1cccc2c1non2)CCCN1C(=S)S/C(=C\c2ccccc2F)/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 C20H15FN4O3S2 MW 442.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15FN4O3S2/c21-13-6-2-1-5-12(13)11-16-19(27)25(20(29)30-16)10-4-9-17(26)22-14-7-3-8-15-18(14)24-28-23-15/h1-3,5-8,11H,4,9-10H2,(H,22,26)/b16-11-
InChIKey
IFNUCLZKTITMQP-WJDWOHSUSA-N
Synonyms
902335-94-8
(Z)N(benzo(c)(125)oxadiazol4yl)4(5(2fluorobenzylidene)4oxo2thioxothiazolidin3yl)butanamide
902335948
C1=CC=C(C(=C1)C=C2C(=O)N(C(=S)S2)CCCC(=O)NC3=CC=CC4=NON=C43)F
InChI=1SC20H15FN4O3S2c2113621512(13)111619(27)25(20(29)3016)104917(26)22147381518(14)24282315h135811H4910H2(H2226)b1611
MFCD06789002
N(213BENZOXADIAZOL4YL)4((5Z)5((2FLUOROPHENYL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)BUTANAMIDE
N(213benzoxadiazol4yl)4((5Z)5(2fluorobenzylidene)4oxo2thioxo13thiazolidin3yl)butanamide
NBENZO(C)125OXADIAZOL4YL4(5((2FLUOROPHENYL)METHYLENE)4OXO2THIOXO(13THIAZOLIDIN3YL))BUTANAMIDE
O=C(Nc1cccc2c1non2)CCCN1C(=S)SC(=Cc2ccccc2F)C1=O
ZINC000013573720
ZINC13573720

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Available files

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