Vitas-M small molecule compound

3-{4-[(Z)-(3-cyclohexyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-1-phenyl-1H-pyrazol-3-yl}-N,N-dimethylbenzenesulfonamide

Catalog ID
STL055966
SMILES S=C1S/C(=C\c2cn(nc2c2cccc(c2)S(=O)(=O)N(C)C)c2ccccc2)/C(=O)N1C1CCCCC1

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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 C27H28N4O3S3 MW 552.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N4O3S3/c1-29(2)37(33,34)23-15-9-10-19(16-23)25-20(18-30(28-25)21-11-5-3-6-12-21)17-24-26(32)31(27(35)36-24)22-13-7-4-8-14-22/h3,5-6,9-12,15-18,22H,4,7-8,13-14H2,1-2H3/b24-17-
InChIKey
FDGKAHXSMKDWRD-ULJHMMPZSA-N
Synonyms

(Z)3(4((3cyclohexyl4oxo2thioxothiazolidin5ylidene)methyl)1phenyl1Hpyrazol3yl)NNdimethylbenzenesulfonamide
3(4((Z)(3CYCLOHEXYL4OXO2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)1PHENYLPYRAZOL3YL)NNDIMETHYLBENZENESULFONAMIDE
3(4((Z)(3cyclohexyl4oxo2thioxo13thiazolidin5ylidene)methyl)1phenyl1Hpyrazol3yl)NNdimethylbenzenesulfonamide
CN(C)S(=O)(=O)C1=CC=CC(=C1)C2=NN(C=C2C=C3C(=O)N(C(=S)S3)C4CCCCC4)C5=CC=CC=C5
InChI=1SC27H28N4O3S3c129(2)37(3334)231591019(1623)2520(1830(2825)21115361221)172426(32)31(27(35)3624)22137481422h356912151822H4781314H212H3b2417
MFCD04175049
S=C1SC(=Cc2cn(nc2c2cccc(c2)S(=O)(=O)N(C)C)c2ccccc2)C(=O)N1C1CCCCC1
ZINC000097970575
ZINC000103127253
ZINC97970575

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Available files

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