Vitas-M small molecule compound

3-[(5Z)-5-(3-fluorobenzylidene)-2,4-dioxo-1,3-thiazolidin-3-yl]-N-[(2R)-1-hydroxy-3-phenylpropan-2-yl]propanamide

Catalog ID
STK658827
SMILES OCC(Cc1ccccc1)NC(=O)CCN1C(=O)S/C(=C\c2cccc(c2)F)/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 C22H21FN2O4S MW 428.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21FN2O4S/c23-17-8-4-7-16(11-17)13-19-21(28)25(22(29)30-19)10-9-20(27)24-18(14-26)12-15-5-2-1-3-6-15/h1-8,11,13,18,26H,9-10,12,14H2,(H,24,27)/b19-13-/t18-/m1/s1
InChIKey
XZIKOCNHAJPGGI-ZJYZBMPFSA-N
Synonyms
1014021-13-6
(RZ)3(5(3fluorobenzylidene)24dioxothiazolidin3yl)N(1hydroxy3phenylpropan2yl)propanamide
1014021136
3((5Z)5((3fluorophenyl)methylidene)24dioxo13thiazolidin3yl)N((2R)1hydroxy3phenylpropan2yl)propanamide
3((5Z)5(3fluorobenzylidene)24dioxo13thiazolidin3yl)N((2R)1hydroxy3phenylpropan2yl)propanamide
C1=CC=C(C=C1)CC(CO)NC(=O)CCN2C(=O)C(=CC3=CC(=CC=C3)F)SC2=O
InChI=1SC22H21FN2O4Sc231784716(1117)131921(28)25(22(29)3019)10920(27)2418(1426)12155213615h1811131826H9101214H2(H2427)b1913t18m1s1
MFCD18246803
OC(C@@H)(Cc1ccccc1)NC(=O)CCN1C(=O)SC(=Cc2cccc(c2)F)C1=O
OCC(Cc1ccccc1)NC(=O)CCN1C(=O)SC(=Cc2cccc(c2)F)C1=O
ZINC000013574188
ZINC13574188

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Available files

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