Vitas-M small molecule compound

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

Catalog ID
STK813838
SMILES CC(COc1ccc(cc1)c1nn(cc1/C=C/1\SC(=S)N(C1=O)C(c1ccccc1)C)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/c1-21(2)20-36-27-16-14-24(15-17-27)29-25(19-33(32-29)26-12-8-5-9-13-26)18-28-30(35)34(31(37)38-28)22(3)23-10-6-4-7-11-23/h4-19,21-22H,20H2,1-3H3/b28-18-
InChIKey
GBQFUXKNDRBCLK-VEILYXNESA-N
Synonyms

(5Z)5((3(4(2methylpropoxy)phenyl)1phenyl1Hpyrazol4yl)methylidene)3(1phenylethyl)2thioxo13thiazolidin4one
(5Z)5((3(4(2METHYLPROPOXY)PHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)3(1PHENYLETHYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)5((3(4isobutoxyphenyl)1phenyl1Hpyrazol4yl)methylene)3(1phenylethyl)2thioxothiazolidin4one
5((3(4ISOBUTOXYPHENYL)1PHENYL1HPYRAZOL4YL)METHYLENE)3(1PHENYLETHYL)2THIOXOTHIAZOLIDIN4ONE
CC(C)COC1=CC=C(C=C1)C2=NN(C=C2C=C3C(=O)N(C(=S)S3)C(C)C4=CC=CC=C4)C5=CC=CC=C5
CC(COc1ccc(cc1)c1nn(cc1C=C1SC(=S)N(C1=O)C(c1ccccc1)C)c1ccccc1)C
InChI=1SC31H29N3O2S2c121(2)203627161424(151727)2925(1933(3229)26128591326)182830(35)34(31(37)3828)22(3)23106471123h4192122H20H213H3b2818
MFCD03213412
ZINC000002364699
ZINC000100871838

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Available files

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