Vitas-M small molecule compound

6-[(5Z)-5-{[3-(4-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]hexanoic acid

Catalog ID
STK706289
SMILES COc1ccc(cc1)c1nn(cc1/C=C/1\SC(=S)N(C1=O)CCCCCC(=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 C26H25N3O4S2 MW 507.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25N3O4S2/c1-33-21-13-11-18(12-14-21)24-19(17-29(27-24)20-8-4-2-5-9-20)16-22-25(32)28(26(34)35-22)15-7-3-6-10-23(30)31/h2,4-5,8-9,11-14,16-17H,3,6-7,10,15H2,1H3,(H,30,31)/b22-16-
InChIKey
YBUORFIYBWKHBX-JWGURIENSA-N
Synonyms
312745-96-3
(Z)6(5((3(4methoxyphenyl)1phenyl1Hpyrazol4yl)methylene)4oxo2thioxothiazolidin3yl)hexanoicacid
312745963
6((5Z)5((3(4methoxyphenyl)1phenyl1Hpyrazol4yl)methylidene)4oxo2thioxo13thiazolidin3yl)hexanoicacid
6((5Z)5((3(4METHOXYPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)HEXANOICACID
6(5((3(4METHOXYPHENYL)1PHENYLPYRAZOL4YL)METHYLENE)4OXO2THIOXO13THIAZOLIDIN3YL)HEXANOICACID
COC1=CC=C(C=C1)C2=NN(C=C2C=C3C(=O)N(C(=S)S3)CCCCCC(=O)O)C4=CC=CC=C4
COc1ccc(cc1)c1nn(cc1C=C1SC(=S)N(C1=O)CCCCCC(=O)O)c1ccccc1
InChI=1SC26H25N3O4S2c13321131118(121421)2419(1729(2724)208425920)162225(32)28(26(34)3522)157361023(30)31h2458911141617H3671015H21H3(H3031)b2216
MFCD01949303
ZINC000009330841
ZINC9330841

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Available files

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