Vitas-M small molecule compound
(5Z)-5-{[3-(4-butoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-3-(2-phenylethyl)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK703147
SMILES CCCCOc1ccc(cc1)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 C31H29N3O2S2 MW 539.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H29N3O2S2/c1-2-3-20-36-27-16-14-24(15-17-27)29-25(22-34(32-29)26-12-8-5-9-13-26)21-28-30(35)33(31(37)38-28)19-18-23-10-6-4-7-11-23/h4-17,21-22H,2-3,18-20H2,1H3/b28-21-InChIKey
DXKSAZQBDYHWDV-HFTWOUSFSA-NSynonyms
(5Z)5((3(4butoxyphenyl)1phenyl1Hpyrazol4yl)methylidene)3(2phenylethyl)2thioxo13thiazolidin4one
(5Z)5((3(4butoxyphenyl)1phenylpyrazol4yl)methylidene)3(2phenylethyl)2sulfanylidene13thiazolidin4one
(5Z)5((3(4BUTOXYPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)3PHENETHYL2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)5((3(4butoxyphenyl)1phenyl1Hpyrazol4yl)methylene)3phenethyl2thioxothiazolidin4one
CCCCOC1=CC=C(C=C1)C2=NN(C=C2C=C3C(=O)N(C(=S)S3)CCC4=CC=CC=C4)C5=CC=CC=C5
CCCCOc1ccc(cc1)c1nn(cc1C=C1SC(=S)N(C1=O)CCc1ccccc1)c1ccccc1
InChI=1SC31H29N3O2S2c123203627161424(151727)2925(2234(3229)26128591326)212830(35)33(31(37)3828)191823106471123h4172122H231820H21H3b2821
MFCD02996235
ZINC000100793020
ZINC100793020
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