Vitas-M small molecule compound

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

Catalog ID
STK881134
SMILES CCCCSc1ccc(cc1)c1nn(cc1/C=C/1\SC(=S)N(C1=O)CCCC)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 C27H29N3OS3 MW 507.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29N3OS3/c1-3-5-16-29-26(31)24(34-27(29)32)18-21-19-30(22-10-8-7-9-11-22)28-25(21)20-12-14-23(15-13-20)33-17-6-4-2/h7-15,18-19H,3-6,16-17H2,1-2H3/b24-18-
InChIKey
YCUUBROZWKKOIB-MOHJPFBDSA-N
Synonyms
1009434-10-9
(5Z)3butyl5((3(4(butylsulfanyl)phenyl)1phenyl1Hpyrazol4yl)methylidene)2thioxo13thiazolidin4one
(5Z)3BUTYL5((3(4BUTYLSULFANYLPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)3butyl5((3(4(butylthio)phenyl)1phenyl1Hpyrazol4yl)methylene)2thioxothiazolidin4one
1009434109
CCCCN1C(=O)C(=CC2=CN(N=C2C3=CC=C(C=C3)SCCCC)C4=CC=CC=C4)SC1=S
CCCCSc1ccc(cc1)c1nn(cc1C=C1SC(=S)N(C1=O)CCCC)c1ccccc1
InChI=1SC27H29N3OS3c135162926(31)24(3427(29)32)18211930(22108791122)2825(21)20121423(151320)3317642h7151819H361617H212H3b2418
MFCD03688512
ZINC000009461639
ZINC09461639
ZINC9461639

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Available files

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