Vitas-M small molecule compound

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

Catalog ID
STK706796
SMILES CCCCOc1cccc(c1)c1nn(cc1/C=C/1\SC(=S)N(C1=O)Cc1ccco1)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 C28H25N3O3S2 MW 515.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25N3O3S2/c1-2-3-14-33-23-12-7-9-20(16-23)26-21(18-31(29-26)22-10-5-4-6-11-22)17-25-27(32)30(28(35)36-25)19-24-13-8-15-34-24/h4-13,15-18H,2-3,14,19H2,1H3/b25-17-
InChIKey
RITCOQYXEBTTIC-UQQQWYQISA-N
Synonyms
1009190-30-0
(5Z)5((3(3butoxyphenyl)1phenyl1Hpyrazol4yl)methylidene)3(furan2ylmethyl)2thioxo13thiazolidin4one
(5Z)5((3(3BUTOXYPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)3(FURAN2YLMETHYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)5((3(3butoxyphenyl)1phenyl1Hpyrazol4yl)methylene)3(furan2ylmethyl)2thioxothiazolidin4one
1009190300
CCCCOC1=CC=CC(=C1)C2=NN(C=C2C=C3C(=O)N(C(=S)S3)CC4=CC=CO4)C5=CC=CC=C5
CCCCOc1cccc(c1)c1nn(cc1C=C1SC(=S)N(C1=O)Cc1ccco1)c1ccccc1
InChI=1SC28H25N3O3S2c123143323127920(1623)2621(1831(2926)22105461122)172527(32)30(28(35)3625)1924138153424h4131518H231419H21H3b2517
MFCD04028914
ZINC000009460806
ZINC09460806
ZINC9460806

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Available files

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