Vitas-M small molecule compound
3-[(5Z)-5-({3-[4-(hexyloxy)phenyl]-1-phenyl-1H-pyrazol-4-yl}methylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]propanoic acid
Catalog ID
STK598256
SMILES CCCCCCOc1ccc(cc1)c1nn(cc1/C=C/1\SC(=S)N(C1=O)CCC(=O)O)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 C28H29N3O4S2 MW 535.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29N3O4S2/c1-2-3-4-8-17-35-23-13-11-20(12-14-23)26-21(19-31(29-26)22-9-6-5-7-10-22)18-24-27(34)30(28(36)37-24)16-15-25(32)33/h5-7,9-14,18-19H,2-4,8,15-17H2,1H3,(H,32,33)/b24-18-InChIKey
XDXPGGRPNQCCLN-MOHJPFBDSA-NSynonyms
956747-26-5(Z)3(5((3(4(hexyloxy)phenyl)1phenyl1Hpyrazol4yl)methylene)4oxo2thioxothiazolidin3yl)propanoicacid
3((5Z)5((3(4(hexyloxy)phenyl)1phenyl1Hpyrazol4yl)methylidene)4oxo2thioxo13thiazolidin3yl)propanoicacid
3((5Z)5((3(4HEXOXYPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)PROPANOICACID
956747265
CCCCCCOC1=CC=C(C=C1)C2=NN(C=C2C=C3C(=O)N(C(=S)S3)CCC(=O)O)C4=CC=CC=C4
CCCCCCOc1ccc(cc1)c1nn(cc1C=C1SC(=S)N(C1=O)CCC(=O)O)c1ccccc1
InChI=1SC28H29N3O4S2c12348173523131120(121423)2621(1931(2926)2296571022)182427(34)30(28(36)3724)161525(32)33h579141819H2481517H21H3(H3233)b2418
MFCD03663316
ZINC000100955790
ZINC100955790
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Check stock on Vitas-MAvailable files
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