Vitas-M small molecule compound
(2E)-2-[(4-methylphenyl)sulfonyl]-3-{1-phenyl-3-[4-(piperidin-1-ylsulfonyl)phenyl]-1H-pyrazol-4-yl}prop-2-enenitrile
Catalog ID
STK703941
SMILES N#C/C(=C\c1cn(nc1c1ccc(cc1)S(=O)(=O)N1CCCCC1)c1ccccc1)/S(=O)(=O)c1ccc(cc1)C
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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 C30H28N4O4S2 MW 572.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H28N4O4S2/c1-23-10-14-27(15-11-23)39(35,36)29(21-31)20-25-22-34(26-8-4-2-5-9-26)32-30(25)24-12-16-28(17-13-24)40(37,38)33-18-6-3-7-19-33/h2,4-5,8-17,20,22H,3,6-7,18-19H2,1H3/b29-20+InChIKey
XCYMZAQCMVXWQI-ZTKZIYFRSA-NSynonyms
6616-22-4(2E)2((4methylphenyl)sulfonyl)3(1phenyl3(4(piperidin1ylsulfonyl)phenyl)1Hpyrazol4yl)prop2enenitrile
(E)2(4METHYLPHENYL)SULFONYL3(1PHENYL3(4PIPERIDIN1YLSULFONYLPHENYL)PYRAZOL4YL)PROP2ENENITRILE
6616224
CC1=CC=C(C=C1)S(=O)(=O)C(=CC2=CN(N=C2C3=CC=C(C=C3)S(=O)(=O)N4CCCCC4)C5=CC=CC=C5)C#N
InChI=1SC30H28N4O4S2c123101427(151123)39(3536)29(2131)20252234(268425926)3230(25)24121628(171324)40(3738)33186371933h2458172022H3671819H21H3b2920+
MFCD04520860
N#CC(=Cc1cn(nc1c1ccc(cc1)S(=O)(=O)N1CCCCC1)c1ccccc1)S(=O)(=O)c1ccc(cc1)C
ZINC000097946601
ZINC97946601
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