Vitas-M small molecule compound

[(5Z)-5-{[3-(3-chloro-4-propoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]acetic acid

Catalog ID
STK706620
SMILES CCCOc1ccc(cc1Cl)c1nn(cc1/C=C/1\SC(=S)N(C1=O)CC(=O)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 C24H20ClN3O4S2 MW 514.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20ClN3O4S2/c1-2-10-32-19-9-8-15(11-18(19)25)22-16(13-28(26-22)17-6-4-3-5-7-17)12-20-23(31)27(14-21(29)30)24(33)34-20/h3-9,11-13H,2,10,14H2,1H3,(H,29,30)/b20-12-
InChIKey
WZMCYMCNNYJVNA-NDENLUEZSA-N
Synonyms
1009435-85-1
((5Z)5((3(3chloro4propoxyphenyl)1phenyl1Hpyrazol4yl)methylidene)4oxo2thioxo13thiazolidin3yl)aceticacid
(Z)2(5((3(3chloro4propoxyphenyl)1phenyl1Hpyrazol4yl)methylene)4oxo2thioxothiazolidin3yl)aceticacid
1009435851
2((5Z)5((3(3CHLORO4PROPOXYPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)ACETICACID
CCCOC1=C(C=C(C=C1)C2=NN(C=C2C=C3C(=O)N(C(=S)S3)CC(=O)O)C4=CC=CC=C4)Cl
CCCOc1ccc(cc1Cl)c1nn(cc1C=C1SC(=S)N(C1=O)CC(=O)O)c1ccccc1
InChI=1SC24H20ClN3O4S2c121032199815(1118(19)25)2216(1328(2622)176435717)122023(31)27(1421(29)30)24(33)3420h391113H21014H21H3(H2930)b2012
MFCD04005445
ZINC000002261256
ZINC2261256

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Available files

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