Vitas-M small molecule compound

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

Catalog ID
STK797021
SMILES CC(COc1ccc(cc1)c1nn(cc1/C=C/1\SC(=S)N(C1=O)CCc1ccccc1)c1ccccc1)C

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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 C31H29N3O2S2 MW 539.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H29N3O2S2/c1-22(2)21-36-27-15-13-24(14-16-27)29-25(20-34(32-29)26-11-7-4-8-12-26)19-28-30(35)33(31(37)38-28)18-17-23-9-5-3-6-10-23/h3-16,19-20,22H,17-18,21H2,1-2H3/b28-19-
InChIKey
QBHKYNMFJUGCDN-USHMODERSA-N
Synonyms
955867-94-4
(5Z)5((3(4(2methylpropoxy)phenyl)1phenyl1Hpyrazol4yl)methylidene)3(2phenylethyl)2thioxo13thiazolidin4one
(5Z)5((3(4(2methylpropoxy)phenyl)1phenylpyrazol4yl)methylidene)3(2phenylethyl)2sulfanylidene13thiazolidin4one
(5Z)5((3(4(2METHYLPROPOXY)PHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)3PHENETHYL2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)5((3(4isobutoxyphenyl)1phenyl1Hpyrazol4yl)methylene)3phenethyl2thioxothiazolidin4one
5((3(4(2METHYLPROPOXY)PHENYL)1PHENYLPYRAZOL4YL)METHYLENE)3(2PHENYLETHYL)2THIOXO13THIAZOLIDIN4ONE
955867944
CC(C)COC1=CC=C(C=C1)C2=NN(C=C2C=C3C(=O)N(C(=S)S3)CCC4=CC=CC=C4)C5=CC=CC=C5
CC(COc1ccc(cc1)c1nn(cc1C=C1SC(=S)N(C1=O)CCc1ccccc1)c1ccccc1)C
InChI=1SC31H29N3O2S2c122(2)213627151324(141627)2925(2034(3229)26117481226)192830(35)33(31(37)3828)18172395361023h316192022H171821H212H3b2819
MFCD03225804
ZINC000100837073
ZINC100837073

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Available files

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