Vitas-M small molecule compound
(2E)-2-cyano-3-{3-[3-(diethylsulfamoyl)phenyl]-1-phenyl-1H-pyrazol-4-yl}-N-(tetrahydrofuran-2-ylmethyl)prop-2-enamide
Catalog ID
STL201000
SMILES CCN(S(=O)(=O)c1cccc(c1)c1nn(cc1/C=C(/C(=O)NCC1CCCO1)\C#N)c1ccccc1)CC
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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 C28H31N5O4S MW 533.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31N5O4S/c1-3-32(4-2)38(35,36)26-14-8-10-21(17-26)27-23(20-33(31-27)24-11-6-5-7-12-24)16-22(18-29)28(34)30-19-25-13-9-15-37-25/h5-8,10-12,14,16-17,20,25H,3-4,9,13,15,19H2,1-2H3,(H,30,34)/b22-16+InChIKey
MZUOAPVWWDYIMT-CJLVFECKSA-NSynonyms
1009442-05-0(2E)2cyano3(3(3(diethylsulfamoyl)phenyl)1phenyl1Hpyrazol4yl)N(tetrahydrofuran2ylmethyl)prop2enamide
(E)2CYANO3(3(3(DIETHYLSULFAMOYL)PHENYL)1PHENYLPYRAZOL4YL)N(OXOLAN2YLMETHYL)PROP2ENAMIDE
(E)2cyano3(3(3(NNdiethylsulfamoyl)phenyl)1phenyl1Hpyrazol4yl)N((tetrahydrofuran2yl)methyl)acrylamide
1009442050
CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C2=NN(C=C2C=C(C#N)C(=O)NCC3CCCO3)C4=CC=CC=C4
InChI=1SC28H31N5O4Sc1332(42)38(3536)261481021(1726)2723(2033(3127)24116571224)1622(1829)28(34)301925139153725h5810121416172025H349131519H212H3(H3034)b2216+
MFCD04183349
ZINC000101147169
ZINC000101147172
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