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-(1-phenylethyl)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK706564
SMILES C=CCOc1ccc(cc1C)c1nn(cc1/C=C/1\SC(=S)N(C1=O)C(c1ccccc1)C)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/c1-4-17-36-27-16-15-24(18-21(27)2)29-25(20-33(32-29)26-13-9-6-10-14-26)19-28-30(35)34(31(37)38-28)22(3)23-11-7-5-8-12-23/h4-16,18-20,22H,1,17H2,2-3H3/b28-19-InChIKey
MPWQOOHCQCPLND-USHMODERSA-NSynonyms
(5Z)5((3(3methyl4(prop2en1yloxy)phenyl)1phenyl1Hpyrazol4yl)methylidene)3(1phenylethyl)2thioxo13thiazolidin4one
(5Z)5((3(3METHYL4PROP2ENOXYPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)3(1PHENYLETHYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)5((3(4(allyloxy)3methylphenyl)1phenyl1Hpyrazol4yl)methylene)3(1phenylethyl)2thioxothiazolidin4one
C=CCOc1ccc(cc1C)c1nn(cc1C=C1SC(=S)N(C1=O)C(c1ccccc1)C)c1ccccc1
CC1=C(C=CC(=C1)C2=NN(C=C2C=C3C(=O)N(C(=S)S3)C(C)C4=CC=CC=C4)C5=CC=CC=C5)OCC=C
InChI=1SC31H27N3O2S2c14173627161524(1821(27)2)2925(2033(3229)261396101426)192830(35)34(31(37)3828)22(3)23117581223h416182022H117H223H3b2819
MFCD02993367
ZINC000002300164
ZINC000002300165
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