Vitas-M small molecule compound

3-[(5Z)-5-(2-fluorobenzylidene)-2,4-dioxo-1,3-thiazolidin-3-yl]-N-[2-(1H-imidazol-5-yl)ethyl]propanamide

Catalog ID
STK622834
SMILES O=C(CCN1C(=O)S/C(=C\c2ccccc2F)/C1=O)NCCc1[nH]cnc1

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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 C18H17FN4O3S MW 388.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17FN4O3S/c19-14-4-2-1-3-12(14)9-15-17(25)23(18(26)27-15)8-6-16(24)21-7-5-13-10-20-11-22-13/h1-4,9-11H,5-8H2,(H,20,22)(H,21,24)/b15-9-
InChIKey
JAMUEDVOSBTCJR-DHDCSXOGSA-N
Synonyms
902031-32-7
(Z)N(2(1Himidazol4yl)ethyl)3(5(2fluorobenzylidene)24dioxothiazolidin3yl)propanamide
3((5Z)5((2FLUOROPHENYL)METHYLIDENE)24DIOXO13THIAZOLIDIN3YL)N(2(1HIMIDAZOL5YL)ETHYL)PROPANAMIDE
3((5Z)5(2fluorobenzylidene)24dioxo13thiazolidin3yl)N(2(1Himidazol5yl)ethyl)propanamide
3(5((2FLUOROPHENYL)METHYLENE)24DIOXO(13THIAZOLIDIN3YL))N(2IMIDAZOL4YLETHYL)PROPANAMIDE
902031327
C1=CC=C(C(=C1)C=C2C(=O)N(C(=O)S2)CCC(=O)NCCC3=CN=CN3)F
InChI=1SC18H17FN4O3Sc1914421312(14)91517(25)23(18(26)2715)8616(24)2175131020112213h14911H58H2(H2022)(H2124)b159
MFCD09794327
O=C(CCN1C(=O)SC(=Cc2ccccc2F)C1=O)NCCc1(nH)cnc1
O=C(CCN1C(=O)SC(=Cc2ccccc2F)C1=O)NCCc1nc(nH)c1
ZINC000009187712
ZINC09187712
ZINC9187712

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Available files

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