Vitas-M small molecule compound

(5Z)-5-(2-chlorobenzylidene)-3-hexyl-2-thioxo-1,3-thiazolidin-4-one

Catalog ID
STK808692
SMILES CCCCCCN1C(=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 C16H18ClNOS2 MW 339.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18ClNOS2/c1-2-3-4-7-10-18-15(19)14(21-16(18)20)11-12-8-5-6-9-13(12)17/h5-6,8-9,11H,2-4,7,10H2,1H3/b14-11-
InChIKey
KHMWFQAYAWAQPS-KAMYIIQDSA-N
Synonyms

(5Z)5((2CHLOROPHENYL)METHYLIDENE)3HEXYL2SULFANYLIDENE13THIAZOLIDIN4ONE
(5Z)5(2chlorobenzylidene)3hexyl2thioxo13thiazolidin4one
CCCCCCN1C(=O)C(=CC2=CC=CC=C2Cl)SC1=S
CCCCCCN1C(=S)SC(=Cc2ccccc2Cl)C1=O
InChI=1SC16H18ClNOS2c12347101815(19)14(2116(18)20)1112856913(12)17h568911H24710H21H3b1411
MFCD03461075
ZINC000002666887
ZINC02666887
ZINC2666887

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Available files

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