Vitas-M small molecule compound

(5Z)-5-{[3-(3-chloro-4-ethoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-2-thioxo-1,3-thiazolidin-4-one

Catalog ID
STK816174
SMILES CCOc1ccc(cc1Cl)c1nn(cc1/C=C/1\SC(=S)NC1=O)c1ccccc1

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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 C21H16ClN3O2S2 MW 441.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16ClN3O2S2/c1-2-27-17-9-8-13(10-16(17)22)19-14(11-18-20(26)23-21(28)29-18)12-25(24-19)15-6-4-3-5-7-15/h3-12H,2H2,1H3,(H,23,26,28)/b18-11-
InChIKey
MEMHDOVIZZTWSV-WQRHYEAKSA-N
Synonyms
956706-02-8
(5Z)5((3(3chloro4ethoxyphenyl)1phenyl1Hpyrazol4yl)methylidene)2thioxo13thiazolidin4one
(5Z)5((3(3CHLORO4ETHOXYPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)5((3(3chloro4ethoxyphenyl)1phenyl1Hpyrazol4yl)methylene)2thioxothiazolidin4one
956706028
CCOC1=C(C=C(C=C1)C2=NN(C=C2C=C3C(=O)NC(=S)S3)C4=CC=CC=C4)Cl
CCOc1ccc(cc1Cl)c1nn(cc1C=C1SC(=S)NC1=O)c1ccccc1
InChI=1SC21H16ClN3O2S2c1227179813(1016(17)22)1914(111820(26)2321(28)2918)1225(2419)156435715h312H2H21H3(H232628)b1811
MFCD04005554
ZINC000017196808
ZINC17196808

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Available files

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