Vitas-M small molecule compound

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

Catalog ID
STK706523
SMILES C=CCOc1ccc(cc1C)c1nn(cc1/C=C/1\SC(=S)N(C1=O)CCc1ccccc1)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 C31H27N3O2S2 MW 537.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H27N3O2S2/c1-3-18-36-27-15-14-24(19-22(27)2)29-25(21-34(32-29)26-12-8-5-9-13-26)20-28-30(35)33(31(37)38-28)17-16-23-10-6-4-7-11-23/h3-15,19-21H,1,16-18H2,2H3/b28-20-
InChIKey
IDAYUKCHZNLAKM-RRAHZORUSA-N
Synonyms

(5Z)5((3(3methyl4(prop2en1yloxy)phenyl)1phenyl1Hpyrazol4yl)methylidene)3(2phenylethyl)2thioxo13thiazolidin4one
(5Z)5((3(3methyl4prop2enoxyphenyl)1phenylpyrazol4yl)methylidene)3(2phenylethyl)2sulfanylidene13thiazolidin4one
(5Z)5((3(3METHYL4PROP2ENOXYPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)3PHENETHYL2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)5((3(4(allyloxy)3methylphenyl)1phenyl1Hpyrazol4yl)methylene)3phenethyl2thioxothiazolidin4one
C=CCOc1ccc(cc1C)c1nn(cc1C=C1SC(=S)N(C1=O)CCc1ccccc1)c1ccccc1
CC1=C(C=CC(=C1)C2=NN(C=C2C=C3C(=O)N(C(=S)S3)CCC4=CC=CC=C4)C5=CC=CC=C5)OCC=C
InChI=1SC31H27N3O2S2c13183627151424(1922(27)2)2925(2134(3229)26128591326)202830(35)33(31(37)3828)171623106471123h3151921H11618H22H3b2820
MFCD02988510
ZINC000100765851
ZINC100765851

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Available files

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