Vitas-M small molecule compound
3-[(1E)-2-cyano-3-({4-[(4-methylphenyl)sulfamoyl]phenyl}amino)-3-oxoprop-1-en-1-yl]phenyl 4-chlorobenzenesulfonate
Catalog ID
STK016435
SMILES N#C/C(=C\c1cccc(c1)OS(=O)(=O)c1ccc(cc1)Cl)/C(=O)Nc1ccc(cc1)S(=O)(=O)Nc1ccc(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 C29H22ClN3O6S2 MW 608.09 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H22ClN3O6S2/c1-20-5-9-25(10-6-20)33-40(35,36)27-15-11-24(12-16-27)32-29(34)22(19-31)17-21-3-2-4-26(18-21)39-41(37,38)28-13-7-23(30)8-14-28/h2-18,33H,1H3,(H,32,34)/b22-17+InChIKey
FJRAYXQPFHWNHJ-OQKWZONESA-NSynonyms
(3((E)2CYANO3(4((4METHYLPHENYL)SULFAMOYL)ANILINO)3OXOPROP1ENYL)PHENYL)4CHLOROBENZENESULFONATE
3((1E)2CYANO3((4((4METHYLPHENYL)SULFAMOYL)PHENYL)AMINO)3OXOPROP1EN1YL)PHENYL4CHLOROBENZENESULFONATE
CC1=CC=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)C(=CC3=CC(=CC=C3)OS(=O)(=O)C4=CC=C(C=C4)Cl)C#N
InChI=1SC29H22ClN3O6S2c1205925(10620)3340(3536)27151124(121627)3229(34)22(1931)172132426(1821)3941(3738)2813723(30)81428h21833H1H3(H3234)b2217+
MFCD08049638
N#CC(=Cc1cccc(c1)OS(=O)(=O)c1ccc(cc1)Cl)C(=O)Nc1ccc(cc1)S(=O)(=O)Nc1ccc(cc1)C
STK016435
ZINC000097957952
ZINC97957952
Check stock
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