Vitas-M small molecule compound

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

Catalog ID
STK836021
SMILES CCc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)CCCC(=O)Nc1ccc(cc1)Cl

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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 C22H21ClN2O2S2 MW 445.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21ClN2O2S2/c1-2-15-5-7-16(8-6-15)14-19-21(27)25(22(28)29-19)13-3-4-20(26)24-18-11-9-17(23)10-12-18/h5-12,14H,2-4,13H2,1H3,(H,24,26)/b19-14-
InChIKey
ZRLMEWFVYCBWQS-RGEXLXHISA-N
Synonyms
315243-09-5
(Z)N(4chlorophenyl)4(5(4ethylbenzylidene)4oxo2thioxothiazolidin3yl)butanamide
315243095
CCC1=CC=C(C=C1)C=C2C(=O)N(C(=S)S2)CCCC(=O)NC3=CC=C(C=C3)Cl
CCc1ccc(cc1)C=C1SC(=S)N(C1=O)CCCC(=O)Nc1ccc(cc1)Cl
InChI=1SC22H21ClN2O2S2c12155716(8615)141921(27)25(22(28)2919)133420(26)241811917(23)101218h51214H2413H21H3(H2426)b1914
MFCD01947490
N(4CHLOROPHENYL)4((5Z)5((4ETHYLPHENYL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)BUTANAMIDE
N(4chlorophenyl)4((5Z)5(4ethylbenzylidene)4oxo2thioxo13thiazolidin3yl)butanamide
ZINC000013773684
ZINC13773684

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Available files

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