Vitas-M small molecule compound

(2E)-2-cyano-3-{3-[3-(diethylsulfamoyl)phenyl]-1-phenyl-1H-pyrazol-4-yl}-N-(furan-2-ylmethyl)prop-2-enamide

Catalog ID
STK904623
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 C28H27N5O4S MW 529.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H27N5O4S/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/h5-17,20H,3-4,19H2,1-2H3,(H,30,34)/b22-16+
InChIKey
NBECBHAVJJNOJC-CJLVFECKSA-N
Synonyms
958955-96-9
(2E)2cyano3(3(3(diethylsulfamoyl)phenyl)1phenyl1Hpyrazol4yl)N(furan2ylmethyl)prop2enamide
(E)2CYANO3(3(3(DIETHYLSULFAMOYL)PHENYL)1PHENYLPYRAZOL4YL)N(FURAN2YLMETHYL)PROP2ENAMIDE
(E)2cyano3(3(3(NNdiethylsulfamoyl)phenyl)1phenyl1Hpyrazol4yl)N(furan2ylmethyl)acrylamide
(E)2CYANO3(3(3DIETHYLSULFAMOYLPHENYL)1PHENYL1HPYRAZOL4YL)NFURAN2YLMETHYLACRYLAMIDE
958955969
CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C2=NN(C=C2C=C(C#N)C(=O)NCC3=CC=CO3)C4=CC=CC=C4
CCN(S(=O)(=O)c1cccc(c1)c1nn(cc1C=C(C(=O)NCc1ccco1)C#N)c1ccccc1)CC
InChI=1SC28H27N5O4Sc1332(42)38(3536)261481021(1726)2723(2033(3127)24116571224)1622(1829)28(34)301925139153725h51720H3419H212H3(H3034)b2216+
MFCD04178611
ZINC000008691449
ZINC8691449

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Available files

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