Vitas-M small molecule compound

propyl 4-[(5Z)-5-(2-chlorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanoate

Catalog ID
STK533195
SMILES CCCOC(=O)CCCN1C(=S)S/C(=C\c2ccccc2Cl)/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 C17H18ClNO3S2 MW 383.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18ClNO3S2/c1-2-10-22-15(20)8-5-9-19-16(21)14(24-17(19)23)11-12-6-3-4-7-13(12)18/h3-4,6-7,11H,2,5,8-10H2,1H3/b14-11-
InChIKey
MVTGTNCDVFOEOG-KAMYIIQDSA-N
Synonyms

(Z)propyl4(5(2chlorobenzylidene)4oxo2thioxothiazolidin3yl)butanoate
CCCOC(=O)CCCN1C(=O)C(=CC2=CC=CC=C2Cl)SC1=S
CCCOC(=O)CCCN1C(=S)SC(=Cc2ccccc2Cl)C1=O
InChI=1SC17H18ClNO3S2c12102215(20)8591916(21)14(2417(19)23)1112634713(12)18h346711H25810H21H3b1411
MFCD02370004
PROPYL4((5Z)5((2CHLOROPHENYL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)BUTANOATE
propyl4((5Z)5(2chlorobenzylidene)4oxo2thioxo13thiazolidin3yl)butanoate
ZINC000002285276
ZINC02285276
ZINC2285276

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Available files

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