Vitas-M small molecule compound

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

Catalog ID
STK882035
SMILES CCS(=O)(=O)c1ccc(cc1)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 C23H19N3O5S3 MW 513.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19N3O5S3/c1-2-34(30,31)18-10-8-15(9-11-18)21-16(13-26(24-21)17-6-4-3-5-7-17)12-19-22(29)25(14-20(27)28)23(32)33-19/h3-13H,2,14H2,1H3,(H,27,28)/b19-12+
InChIKey
PZRGOYJOWPTFGO-XDHOZWIPSA-N
Synonyms

((5E)5((3(4(ethylsulfonyl)phenyl)1phenyl1Hpyrazol4yl)methylidene)4oxo2thioxo13thiazolidin3yl)aceticacid
2((5E)5((3(4ethylsulfonylphenyl)1phenylpyrazol4yl)methylidene)4oxo2sulfanylidene13thiazolidin3yl)aceticacid
CCS(=O)(=O)C1=CC=C(C=C1)C2=NN(C=C2C=C3C(=O)N(C(=S)S3)CC(=O)O)C4=CC=CC=C4
CCS(=O)(=O)c1ccc(cc1)c1nn(cc1C=C1SC(=S)N(C1=O)CC(=O)O)c1ccccc1
InChI=1SC23H19N3O5S3c1234(3031)1810815(91118)2116(1326(2421)176435717)121922(29)25(1420(27)28)23(32)3319h313H214H21H3(H2728)b1912+
MFCD06645936
ZINC000016742492
ZINC16742492

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Available files

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