Vitas-M small molecule compound
(2Z)-2-[(4-chlorophenyl)sulfonyl]-3-{3-[4-(ethylsulfanyl)phenyl]-1-phenyl-1H-pyrazol-4-yl}prop-2-enenitrile
Catalog ID
STK706817
SMILES CCSc1ccc(cc1)c1nn(cc1/C=C(\S(=O)(=O)c1ccc(cc1)Cl)/C#N)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 C26H20ClN3O2S2 MW 506.05 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H20ClN3O2S2/c1-2-33-23-12-8-19(9-13-23)26-20(18-30(29-26)22-6-4-3-5-7-22)16-25(17-28)34(31,32)24-14-10-21(27)11-15-24/h3-16,18H,2H2,1H3/b25-16-InChIKey
SJTCDLHZSZFKSG-XYGWBWBKSA-NSynonyms
1009434-04-1(2Z)2((4chlorophenyl)sulfonyl)3(3(4(ethylsulfanyl)phenyl)1phenyl1Hpyrazol4yl)prop2enenitrile
(Z)2((4chlorophenyl)sulfonyl)3(3(4(ethylthio)phenyl)1phenyl1Hpyrazol4yl)acrylonitrile
(Z)2(4chlorophenyl)sulfonyl3(3(4ethylsulfanylphenyl)1phenylpyrazol4yl)prop2enenitrile
1009434041
CCSC1=CC=C(C=C1)C2=NN(C=C2C=C(C#N)S(=O)(=O)C3=CC=C(C=C3)Cl)C4=CC=CC=C4
CCSc1ccc(cc1)c1nn(cc1C=C(S(=O)(=O)c1ccc(cc1)Cl)C#N)c1ccccc1
InChI=1SC26H20ClN3O2S2c12332312819(91323)2620(1830(2926)226435722)1625(1728)34(3132)24141021(27)111524h31618H2H21H3b2516
MFCD03688251
ZINC000009164770
ZINC09164770
ZINC9164770
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