Vitas-M small molecule compound

N-[3-(1H-imidazol-1-yl)propyl]-2-{(5Z)-4-oxo-5-[(2E)-3-phenylprop-2-en-1-ylidene]-2-thioxo-1,3-thiazolidin-3-yl}acetamide

Catalog ID
STK611385
SMILES O=C(CN1C(=S)S/C(=C\C=C\c2ccccc2)/C1=O)NCCCn1cncc1

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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 C20H20N4O2S2 MW 412.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N4O2S2/c25-18(22-10-5-12-23-13-11-21-15-23)14-24-19(26)17(28-20(24)27)9-4-8-16-6-2-1-3-7-16/h1-4,6-9,11,13,15H,5,10,12,14H2,(H,22,25)/b8-4+,17-9-
InChIKey
UJQWHLLTFPECCQ-FZAQZHIUSA-N
Synonyms
902026-23-7
2(5((2E)3PHENYLPROP2ENYLIDENE)4OXO2THIOXO(13THIAZOLIDIN3YL))N(3IMIDAZOLYLPROPYL)ACETAMIDE
902026237
C1=CC=C(C=C1)C=CC=C2C(=O)N(C(=S)S2)CC(=O)NCCCN3C=CN=C3
InChI=1SC20H20N4O2S2c2518(2210512231311211523)142419(26)17(2820(24)27)948166213716h1469111315H5101214H2(H2225)b84+179
MFCD06786082
N(3(1Himidazol1yl)propyl)2((5Z)4oxo5((2E)3phenylprop2en1ylidene)2thioxo13thiazolidin3yl)acetamide
N(3(1Himidazol1yl)propyl)2((Z)4oxo5((E)3phenylallylidene)2thioxothiazolidin3yl)acetamide
N(3IMIDAZOL1YLPROPYL)2((5Z)4OXO5((E)3PHENYLPROP2ENYLIDENE)2SULFANYLIDENE13THIAZOLIDIN3YL)ACETAMIDE
O=C(CN1C(=S)SC(=CC=Cc2ccccc2)C1=O)NCCCn1cncc1
ZINC000009187670
ZINC09187670
ZINC9187670

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Available files

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